data_2nc3_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2nc3 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.289 0 N-CA-C 116.26 1.264 . . . . 0.0 116.26 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -73.99 139.26 44.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.876 1.838 . . . . 0.0 113.909 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -151.37 156.76 41.38 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.609 1.564 . . . . 0.0 111.169 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.92 145.19 53.59 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 173.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 tpt85 -142.66 165.31 27.74 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.364 2.266 . . . . 0.0 109.613 -175.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.3 ttm -154.7 134.76 13.07 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.552 -0.718 . . . . 0.0 112.521 -175.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.1 158.55 35.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.32 1.848 . . . . 0.0 115.857 173.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.66 -22.92 65.71 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.7 p30 -80.97 -3.08 50.39 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.381 1.472 . . . . 0.0 114.566 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.96 19.93 48.87 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.745 1.164 . . . . 0.0 115.501 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.0 m -94.58 130.13 41.14 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 118.961 1.38 . . . . 0.0 111.231 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.76 143.16 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.408 1.083 . . . . 0.0 110.104 -176.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -151.25 -172.52 4.23 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.155 1.782 . . . . 0.0 108.834 175.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -123.47 141.85 51.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.323 1.449 . . . . 0.0 110.577 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -135.79 134.97 39.51 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.012 1.325 . . . . 0.0 112.566 -174.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -95.94 115.43 27.41 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.47 0.708 . . . . 0.0 110.671 176.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.46 -23.69 60.12 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.3 mt -84.61 -40.25 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.467 1.507 . . . . 0.0 111.086 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 p -109.21 -6.92 15.38 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -171.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.18 16.25 5.9 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 127.007 2.123 . . . . 0.0 113.932 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.21 154.36 41.07 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.053 -1.029 . . . . 0.0 112.059 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.2 p -143.76 138.53 28.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.889 1.276 . . . . 0.0 111.696 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -154.99 154.11 32.04 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 . . . . . 0 N--CA 1.473 0.712 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -177.231 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.298 0 N-CA-C 116.134 1.214 . . . . 0.0 116.134 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -75.22 137.5 41.29 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.75 1.775 . . . . 0.0 113.919 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -141.73 157.32 45.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.754 2.021 . . . . 0.0 111.106 174.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -68.85 145.11 54.0 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.399 -0.813 . . . . 0.0 112.783 169.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 -144.62 162.61 36.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.15 2.18 . . . . 0.0 109.59 -177.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.7 ptm -154.84 140.26 17.76 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -178.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -71.07 156.57 39.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.329 1.852 . . . . 0.0 114.986 172.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.86 -21.93 66.32 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -78.48 -3.21 42.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.098 1.359 . . . . 0.0 114.472 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.98 18.55 46.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.709 1.147 . . . . 0.0 115.416 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.64 127.37 40.55 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 118.914 1.357 . . . . 0.0 111.61 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.77 143.32 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.672 1.189 . . . . 0.0 110.371 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -150.28 -175.23 5.0 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.252 1.821 . . . . 0.0 109.172 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -120.54 143.88 48.35 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.13 1.372 . . . . 0.0 109.953 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -137.82 134.21 34.9 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.062 1.345 . . . . 0.0 112.14 -176.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -94.37 115.05 27.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.58 0.752 . . . . 0.0 110.78 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -73.64 -22.78 59.88 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -85.9 -40.17 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.427 1.491 . . . . 0.0 111.122 -178.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.6 p -109.32 -7.15 15.28 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 60.43 13.42 4.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.935 2.094 . . . . 0.0 115.306 -175.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.87 155.51 40.45 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.22 1.008 . . . . 0.0 112.272 172.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.8 p -138.35 150.06 46.21 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.044 1.338 . . . . 0.0 111.767 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -153.84 142.05 20.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.247 1.019 . . . . 0.0 110.987 -174.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 . . . . . 0 N--CA 1.474 0.729 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 172.678 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.298 0 N-CA-C 116.041 1.176 . . . . 0.0 116.041 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -76.08 136.73 39.88 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.465 1.632 . . . . 0.0 114.436 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -155.07 144.55 21.26 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.905 1.282 . . . . 0.0 111.579 169.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -58.11 145.16 37.72 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.265 1.426 . . . . 0.0 113.519 177.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.43 170.92 15.04 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 127.093 2.157 . . . . 0.0 110.788 -171.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.0 tpp -154.63 129.8 9.62 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.971 0.908 . . . . 0.0 112.153 -169.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -80.01 156.67 27.05 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 171.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.99 65.99 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -82.12 -0.29 44.06 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 125.363 1.465 . . . . 0.0 114.564 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.25 19.64 54.68 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.485 1.041 . . . . 0.0 115.274 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.7 m -94.72 132.14 39.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.747 1.219 . . . . 0.0 112.066 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -94.69 143.14 12.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 124.362 1.065 . . . . 0.0 109.228 -177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -147.79 179.97 7.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.861 1.264 . . . . 0.0 110.378 173.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -119.48 139.29 52.32 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.537 1.935 . . . . 0.0 109.534 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -140.34 139.75 35.46 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.249 0.62 . . . . 0.0 112.296 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -100.64 115.52 30.39 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.273 1.029 . . . . 0.0 110.648 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -73.48 -22.22 60.21 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -86.55 -40.16 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 125.409 1.484 . . . . 0.0 111.134 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.8 p -109.77 -7.38 15.05 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 60.54 13.56 4.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.836 2.055 . . . . 0.0 115.391 -176.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.74 153.02 43.95 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.318 1.047 . . . . 0.0 112.157 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.7 p -142.88 149.97 39.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.753 1.221 . . . . 0.0 112.78 178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -149.18 151.66 34.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.803 1.641 . . . . 0.0 112.598 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 169.657 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 N-CA-C 115.809 1.083 . . . . 0.0 115.809 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -78.89 142.72 36.55 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.496 1.648 . . . . 0.0 113.947 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -152.23 152.09 31.78 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.534 1.934 . . . . 0.0 111.375 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -64.09 145.05 56.6 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.146 -0.971 . . . . 0.0 113.384 174.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.78 164.71 29.37 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.835 2.054 . . . . 0.0 109.968 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.2 ttp -154.74 137.06 14.9 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.528 -0.732 . . . . 0.0 112.64 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -71.54 158.09 36.84 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.186 1.794 . . . . 0.0 115.632 171.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.62 65.98 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -80.14 -3.4 48.72 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.362 1.465 . . . . 0.0 114.471 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.62 21.27 44.41 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.547 1.07 . . . . 0.0 115.382 -177.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.9 m -94.62 124.37 38.61 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.938 1.369 . . . . 0.0 111.249 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.7 t -94.69 142.78 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.274 1.029 . . . . 0.0 110.015 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -149.57 -174.35 4.66 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.117 1.767 . . . . 0.0 109.798 176.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -125.46 142.76 51.33 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.17 1.388 . . . . 0.0 109.871 -176.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.9 133.77 29.04 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.904 1.282 . . . . 0.0 112.8 -169.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -93.41 117.55 30.22 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.271 0.628 . . . . 0.0 110.842 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -74.72 -21.79 59.17 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.4 mt -85.4 -40.13 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.7 1.6 . . . . 0.0 110.987 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.9 p -110.71 -6.47 14.8 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -172.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 60.75 14.9 5.41 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.785 2.034 . . . . 0.0 115.235 -176.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.24 152.42 45.08 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.235 1.014 . . . . 0.0 112.099 172.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.2 p -141.19 147.28 38.1 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.721 1.209 . . . . 0.0 112.009 177.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -157.4 154.4 28.79 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.989 0.915 . . . . 0.0 112.465 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 118.441 2.756 . . . . 0.0 118.441 -177.998 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.372 0 N-CA-C 115.227 0.851 . . . . 0.0 115.227 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -81.04 141.72 34.08 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.958 1.379 . . . . 0.0 114.171 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.55 158.32 42.33 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.52 1.528 . . . . 0.0 111.312 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -60.81 145.16 50.88 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 171.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -145.06 162.68 36.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.024 2.129 . . . . 0.0 109.819 -177.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 56.4 ttp -154.82 135.92 13.89 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.417 -0.802 . . . . 0.0 112.649 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -72.37 159.83 33.36 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 115.867 1.802 . . . . 0.0 115.867 174.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -23.26 66.21 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -81.42 -0.5 41.79 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.213 1.405 . . . . 0.0 114.417 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.95 19.47 55.87 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.695 1.14 . . . . 0.0 115.245 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.0 m -94.65 125.59 39.4 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 118.777 1.288 . . . . 0.0 110.632 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.5 t -94.69 141.93 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.422 1.089 . . . . 0.0 109.951 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.8 p90 -150.91 -172.47 4.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.38 1.872 . . . . 0.0 108.417 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -125.78 144.87 50.45 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.57 1.148 . . . . 0.0 108.865 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -140.75 136.44 32.52 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.067 1.347 . . . . 0.0 112.26 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -93.87 115.33 27.71 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.758 0.823 . . . . 0.0 110.487 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -73.51 -21.99 60.24 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.1 mt -86.2 -40.04 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.745 1.618 . . . . 0.0 111.074 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -111.28 -7.13 14.44 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -171.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 60.84 13.75 4.68 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.746 2.018 . . . . 0.0 115.193 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.99 155.54 40.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.149 0.98 . . . . 0.0 112.057 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.7 p -141.93 148.97 39.53 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.699 1.2 . . . . 0.0 112.237 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -150.8 139.8 21.02 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.212 1.405 . . . . 0.0 112.915 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.51 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.323 0 N-CA-C 116.119 1.207 . . . . 0.0 116.119 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -74.43 137.8 42.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.645 1.722 . . . . 0.0 114.247 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -153.49 153.5 32.56 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.39 1.876 . . . . 0.0 111.104 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -66.42 145.04 56.13 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 175.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -143.1 162.99 34.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.187 2.195 . . . . 0.0 109.517 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.5 ttp -154.72 136.39 14.37 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 112.668 -175.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -71.7 157.91 37.09 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.102 1.761 . . . . 0.0 115.628 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.18 -22.34 65.82 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -80.15 -3.19 47.9 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.323 1.449 . . . . 0.0 114.427 173.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.34 21.78 43.46 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 124.595 1.093 . . . . 0.0 115.322 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -94.64 123.32 38.01 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 118.798 1.299 . . . . 0.0 111.3 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.79 142.56 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.406 1.083 . . . . 0.0 109.683 -175.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -151.05 -175.74 5.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.073 1.749 . . . . 0.0 109.545 177.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -119.65 141.57 49.22 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.654 1.582 . . . . 0.0 110.949 -177.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -139.06 135.81 34.59 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.742 1.217 . . . . 0.0 112.223 -173.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -96.59 115.25 27.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.554 0.742 . . . . 0.0 110.653 176.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.04 -22.61 60.59 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.9 mt -85.76 -40.07 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 125.454 1.502 . . . . 0.0 110.986 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.0 p -109.48 -7.32 15.19 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.175 1.916 . . . . 0.0 116.175 -171.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.52 13.49 4.21 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.936 2.094 . . . . 0.0 115.298 -175.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.21 153.33 43.85 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.187 0.995 . . . . 0.0 112.258 173.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 86.9 p -138.72 148.87 44.45 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.893 1.277 . . . . 0.0 112.052 176.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -157.61 145.91 19.15 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.674 1.19 . . . . 0.0 112.004 -175.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 N--CA 1.472 0.627 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 175.889 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.325 0 N-CA-C 116.122 1.209 . . . . 0.0 116.122 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -73.21 133.24 43.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.875 1.838 . . . . 0.0 113.836 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -144.23 161.69 38.25 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.511 1.924 . . . . 0.0 111.484 173.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -65.49 145.2 56.42 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -143.78 164.09 31.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.216 2.206 . . . . 0.0 109.585 -175.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 77.1 mtm -154.45 136.9 15.0 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -79.6 156.42 27.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.296 1.838 . . . . 0.0 115.441 172.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.34 66.44 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.2 p30 -79.91 -2.95 45.97 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.337 1.455 . . . . 0.0 114.58 174.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.29 20.9 43.4 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.548 1.071 . . . . 0.0 115.444 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.7 m -94.63 134.58 37.05 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.788 1.294 . . . . 0.0 111.63 177.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.7 t -94.71 141.55 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.996 1.318 . . . . 0.0 110.961 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.37 -172.11 4.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.494 1.517 . . . . 0.0 108.718 172.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.38 142.29 51.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.662 1.585 . . . . 0.0 110.392 -176.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.37 134.94 31.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.604 1.161 . . . . 0.0 112.525 -172.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -95.47 113.66 25.35 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.784 0.833 . . . . 0.0 110.614 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -72.53 -22.06 61.09 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.5 -40.11 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.482 1.513 . . . . 0.0 111.062 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -109.51 -6.9 15.25 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 116.177 1.918 . . . . 0.0 116.177 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.62 13.58 4.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.886 2.074 . . . . 0.0 115.276 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.57 153.63 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.158 0.983 . . . . 0.0 112.256 172.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.8 p -140.44 147.0 39.01 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.009 1.324 . . . . 0.0 112.026 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -154.13 143.61 21.52 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.839 0.856 . . . . 0.0 111.915 -175.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 175.975 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.329 0 N-CA-C 116.161 1.225 . . . . 0.0 116.161 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -73.36 139.0 45.69 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.88 1.84 . . . . 0.0 114.209 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.63 152.71 33.2 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.942 1.697 . . . . 0.0 111.42 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -63.72 145.12 56.35 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -146.08 162.18 38.49 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.577 1.951 . . . . 0.0 109.655 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.4 ptm -154.87 140.25 17.72 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.33 156.02 40.0 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.1 1.76 . . . . 0.0 114.885 172.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.06 -21.48 66.19 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -78.29 -3.47 43.08 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.187 1.395 . . . . 0.0 114.435 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.65 20.2 41.5 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 124.601 1.096 . . . . 0.0 115.199 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.2 m -94.62 125.08 39.04 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.867 1.333 . . . . 0.0 111.592 177.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.1 t -94.74 142.49 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.539 1.136 . . . . 0.0 110.348 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -149.46 -172.59 4.17 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.372 1.869 . . . . 0.0 109.359 175.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -127.54 144.16 51.1 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.476 1.511 . . . . 0.0 110.321 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -135.98 137.09 40.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.904 1.281 . . . . 0.0 111.247 -176.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -97.42 115.76 28.36 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.465 0.706 . . . . 0.0 110.85 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -72.89 -24.09 60.81 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.55 -40.23 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.479 1.512 . . . . 0.0 111.089 -178.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.8 p -110.15 -3.53 16.3 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -170.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.319 16.3 p30 53.84 15.04 0.74 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 128.271 2.628 . . . . 0.0 116.071 -174.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.27 156.22 39.11 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.62 1.168 . . . . 0.0 112.308 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.6 p -136.76 149.64 47.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.797 1.239 . . . . 0.0 111.763 173.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -155.8 145.38 21.07 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.539 1.136 . . . . 0.0 111.584 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 175.669 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.371 0 N-CA-C 115.564 0.985 . . . . 0.0 115.564 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -79.81 146.12 32.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.223 1.511 . . . . 0.0 114.107 177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -145.6 157.99 43.9 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.158 2.183 . . . . 0.0 111.581 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -75.75 145.12 41.05 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.774 -0.579 . . . . 0.0 111.347 169.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -146.9 164.29 33.37 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.525 1.53 . . . . 0.0 110.103 -177.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.1 ttm -154.66 135.59 13.76 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.383 -0.823 . . . . 0.0 112.552 -171.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -72.25 158.13 36.42 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.39 1.876 . . . . 0.0 115.6 172.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.21 65.38 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.87 -3.33 50.91 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.424 1.49 . . . . 0.0 114.55 174.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.8 20.92 45.09 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.658 1.123 . . . . 0.0 115.443 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.57 128.55 41.27 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 118.916 1.358 . . . . 0.0 111.289 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.3 t -94.71 142.86 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.185 0.994 . . . . 0.0 110.039 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -148.66 -175.29 4.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.336 1.854 . . . . 0.0 109.274 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -125.2 143.88 50.73 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.179 1.392 . . . . 0.0 110.277 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -141.49 136.93 31.72 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.466 1.107 . . . . 0.0 110.494 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -96.24 119.1 34.13 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.536 0.735 . . . . 0.0 111.081 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -73.75 -23.52 59.76 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.0 mt -84.24 -40.23 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.852 1.661 . . . . 0.0 111.016 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -112.7 -3.01 14.34 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -170.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.327 15.8 p30 53.87 16.84 1.15 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.933 2.493 . . . . 0.0 116.046 -174.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.51 154.75 39.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.417 1.087 . . . . 0.0 111.906 171.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.2 p -144.49 146.57 32.49 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.361 1.064 . . . . 0.0 112.087 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -157.71 156.13 31.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.102 0.961 . . . . 0.0 112.3 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 118.499 2.778 . . . . 0.0 118.499 -177.939 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.296 0 N-CA-C 116.154 1.222 . . . . 0.0 116.154 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -73.56 140.12 46.07 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.918 1.859 . . . . 0.0 114.189 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -149.46 154.79 39.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.674 1.59 . . . . 0.0 110.693 174.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -64.13 145.1 56.52 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 173.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -144.18 163.64 33.02 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.16 2.184 . . . . 0.0 109.651 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 54.1 ttp -154.71 136.33 14.33 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.205 -0.934 . . . . 0.0 112.696 -176.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -72.1 158.04 36.66 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.194 1.798 . . . . 0.0 115.792 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.07 -22.94 66.18 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.4 p30 -80.09 -2.94 46.61 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.302 1.441 . . . . 0.0 114.43 173.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.52 20.61 47.42 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.745 1.164 . . . . 0.0 115.4 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 54.4 m -94.63 124.78 38.87 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 118.941 1.371 . . . . 0.0 111.043 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -94.64 141.91 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.391 1.076 . . . . 0.0 109.395 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.76 -170.32 3.62 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.201 1.8 . . . . 0.0 108.403 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -126.02 143.97 50.9 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.445 1.498 . . . . 0.0 110.163 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -135.69 134.88 39.61 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.163 1.385 . . . . 0.0 112.098 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -95.61 115.22 27.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.436 0.694 . . . . 0.0 110.69 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -73.41 -23.21 60.11 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -85.1 -40.1 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.371 1.468 . . . . 0.0 111.101 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.0 p -108.74 -7.36 15.59 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 60.26 13.64 4.08 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.005 2.122 . . . . 0.0 115.357 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.71 154.53 41.29 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.364 1.065 . . . . 0.0 112.404 173.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -132.95 148.33 52.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.166 1.387 . . . . 0.0 111.689 173.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -156.75 143.19 18.3 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.588 1.155 . . . . 0.0 112.0 -170.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.267 63.4 m-85 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 118.604 2.816 . . . . 0.0 118.604 -175.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.258 0 N-CA-C 116.262 1.265 . . . . 0.0 116.262 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -73.83 140.31 45.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.94 1.87 . . . . 0.0 114.175 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -152.27 150.46 29.8 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.403 1.881 . . . . 0.0 111.238 178.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -66.95 145.05 55.83 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.69 167.09 22.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 127.262 2.225 . . . . 0.0 110.05 -175.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.3 ttm -154.72 134.57 12.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.617 -0.677 . . . . 0.0 112.574 -174.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -71.29 158.55 36.17 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.47 1.908 . . . . 0.0 115.994 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.47 -23.04 65.6 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.3 p30 -81.3 -2.73 50.16 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.278 1.431 . . . . 0.0 114.515 174.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.74 19.75 50.27 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.731 1.158 . . . . 0.0 115.511 -178.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 59.9 m -94.7 131.07 40.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 118.995 1.397 . . . . 0.0 111.253 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.4 t -94.65 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.337 1.055 . . . . 0.0 109.986 -176.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.3 -176.17 5.27 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.949 1.7 . . . . 0.0 109.536 174.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.53 144.69 48.57 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.703 1.601 . . . . 0.0 110.237 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -139.36 135.72 34.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.898 1.279 . . . . 0.0 111.968 -175.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -97.02 116.77 29.81 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.283 0.633 . . . . 0.0 110.799 175.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -74.01 -22.95 59.39 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -176.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.9 mt -85.06 -40.17 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.502 1.521 . . . . 0.0 110.989 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.0 p -110.18 -6.12 15.15 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -171.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 60.17 14.76 4.74 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.796 2.038 . . . . 0.0 115.267 -175.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.56 152.27 45.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.211 1.004 . . . . 0.0 112.183 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.0 p -140.24 142.26 35.82 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.981 1.312 . . . . 0.0 111.914 177.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -155.08 146.39 22.91 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.181 0.993 . . . . 0.0 111.915 -174.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 176.772 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.255 0 N-CA-C 115.653 1.021 . . . . 0.0 115.653 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -76.9 140.96 40.71 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 119.461 1.631 . . . . 0.0 113.785 178.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -153.48 154.38 34.27 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.945 1.698 . . . . 0.0 111.438 176.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -57.01 145.36 30.69 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -146.93 164.34 33.25 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.685 1.994 . . . . 0.0 110.5 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 53.1 ttp -154.79 135.84 13.86 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.61 -0.681 . . . . 0.0 112.615 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -71.05 158.15 36.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.192 1.797 . . . . 0.0 115.65 172.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.98 65.99 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.2 p30 -80.36 -3.08 48.18 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.349 1.46 . . . . 0.0 114.455 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.01 20.07 48.09 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.737 1.16 . . . . 0.0 115.416 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 56.1 m -94.68 126.11 39.77 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 119.026 1.413 . . . . 0.0 111.16 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.5 t -94.68 142.26 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.279 1.031 . . . . 0.0 109.85 -174.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -150.34 -173.05 4.33 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.192 1.797 . . . . 0.0 109.032 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -128.16 141.73 51.39 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.38 1.472 . . . . 0.0 109.034 -175.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -137.98 134.16 34.55 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.831 1.253 . . . . 0.0 112.126 -170.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -92.97 114.73 27.37 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 110.678 177.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.03 -22.67 60.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.7 mt -85.13 -40.18 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 111.056 -177.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 p -111.76 -6.81 14.27 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -171.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 60.76 14.13 4.87 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.766 2.026 . . . . 0.0 115.193 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.95 155.57 39.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.088 0.955 . . . . 0.0 112.217 172.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 70.8 p -141.91 145.32 34.43 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.868 1.267 . . . . 0.0 111.993 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -152.14 142.72 22.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.297 1.039 . . . . 0.0 111.703 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 117.167 2.284 . . . . 0.0 117.167 176.485 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.395 0 N-CA-C 116.15 1.22 . . . . 0.0 116.15 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -73.66 135.79 43.78 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.943 1.872 . . . . 0.0 113.832 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -145.66 163.75 33.89 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.904 1.682 . . . . 0.0 112.243 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.43 145.12 56.59 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 172.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -143.5 161.67 37.83 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.213 2.205 . . . . 0.0 109.769 -176.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.7 ttt -154.77 131.37 10.6 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -171.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -77.69 155.09 31.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.589 1.955 . . . . 0.0 115.514 175.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -22.36 66.82 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -79.94 -0.79 36.58 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.61 13.14 56.02 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 124.701 1.144 . . . . 0.0 115.418 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 30.9 m -94.68 127.56 40.75 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.863 1.331 . . . . 0.0 112.343 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.79 142.98 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.475 1.11 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -149.62 -169.02 3.27 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.328 1.851 . . . . 0.0 108.83 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -127.46 145.37 50.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.573 1.549 . . . . 0.0 110.429 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -141.2 134.63 29.79 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.107 1.363 . . . . 0.0 112.241 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -94.73 115.78 27.94 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.726 176.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.71 -22.42 59.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.6 mt -85.68 -40.13 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.508 1.523 . . . . 0.0 111.08 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -110.49 -6.02 15.01 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -171.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.35 14.66 4.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.819 2.047 . . . . 0.0 115.302 -176.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.75 152.51 45.23 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.146 0.979 . . . . 0.0 112.161 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 56.6 p -139.8 144.24 37.26 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.99 1.316 . . . . 0.0 111.986 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -156.79 143.76 18.66 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.455 1.102 . . . . 0.0 111.049 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.253 43.3 t80 . . . . . 0 N--CA 1.47 0.543 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 177.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.344 0 N-CA-C 116.075 1.19 . . . . 0.0 116.075 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -73.72 138.23 44.51 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.72 1.76 . . . . 0.0 113.943 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.72 154.7 36.82 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.157 1.783 . . . . 0.0 111.205 175.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -62.55 145.02 55.39 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -144.11 163.54 33.28 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.169 2.188 . . . . 0.0 109.74 -176.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.1 ttm -154.71 135.06 13.28 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.412 -0.805 . . . . 0.0 112.521 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -71.25 158.14 36.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.271 1.828 . . . . 0.0 115.81 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -22.57 65.42 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.83 -3.32 50.72 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.396 1.478 . . . . 0.0 114.505 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.83 21.03 44.5 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 124.721 1.153 . . . . 0.0 115.448 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.2 m -94.61 127.03 40.29 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.999 1.4 . . . . 0.0 111.237 178.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.6 t -94.65 142.96 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.431 1.092 . . . . 0.0 110.359 -176.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -151.39 -175.61 5.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.114 1.765 . . . . 0.0 109.199 175.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -118.93 142.67 47.56 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.955 1.302 . . . . 0.0 110.351 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -135.94 134.59 38.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.243 1.417 . . . . 0.0 112.706 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -96.31 114.62 26.32 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.432 0.693 . . . . 0.0 110.77 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -73.41 -22.84 60.13 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.6 mt -85.14 -40.16 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.357 1.463 . . . . 0.0 111.048 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 p -108.62 -7.04 15.76 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -172.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.41 13.29 3.98 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.922 2.089 . . . . 0.0 115.313 -175.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.66 152.63 45.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.055 0.942 . . . . 0.0 112.116 173.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.1 p -138.8 145.46 40.14 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.6 1.16 . . . . 0.0 111.482 174.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -157.05 143.81 18.4 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.092 0.957 . . . . 0.0 112.286 -174.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 176.321 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 N-CA-C 116.239 1.256 . . . . 0.0 116.239 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -73.17 139.08 46.09 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.807 1.804 . . . . 0.0 114.088 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.79 152.09 33.29 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.807 1.643 . . . . 0.0 111.434 174.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -59.75 145.41 45.27 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 175.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -146.5 163.08 36.86 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.56 1.944 . . . . 0.0 110.592 -178.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.6 ptp -154.91 140.1 17.54 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -178.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.0 156.76 37.2 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.584 1.953 . . . . 0.0 115.221 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -22.03 66.27 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.7 p30 -79.0 -3.18 43.79 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.23 1.412 . . . . 0.0 114.593 174.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.24 19.16 47.11 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.675 1.131 . . . . 0.0 115.469 -178.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.5 m -94.59 129.75 41.3 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 118.834 1.317 . . . . 0.0 111.613 177.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.73 142.96 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.566 1.147 . . . . 0.0 110.299 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -149.18 -171.76 3.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.307 1.843 . . . . 0.0 108.81 174.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -128.49 143.9 51.05 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.449 1.5 . . . . 0.0 109.885 -177.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -134.15 134.56 42.3 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.21 1.404 . . . . 0.0 112.251 -176.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -96.13 115.0 26.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.476 0.71 . . . . 0.0 110.821 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.48 -22.99 60.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -85.33 -40.09 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.3 1.44 . . . . 0.0 111.053 -178.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.72 -6.85 15.74 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 60.23 13.73 4.11 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.991 2.116 . . . . 0.0 115.296 -175.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.85 153.08 43.78 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.248 1.019 . . . . 0.0 112.343 173.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.9 p -137.04 141.19 42.46 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.15 1.38 . . . . 0.0 111.496 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -153.39 144.02 22.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.158 0.983 . . . . 0.0 112.28 -172.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 178.468 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.392 0 N-CA-C 116.198 1.239 . . . . 0.0 116.198 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.0 m95 -85.22 144.54 28.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 118.706 1.253 . . . . 0.0 113.407 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.25 150.5 33.81 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.835 1.654 . . . . 0.0 111.23 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -65.82 145.04 56.44 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 176.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -144.75 165.83 26.96 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.233 2.213 . . . . 0.0 109.571 -175.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -154.79 135.86 13.86 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.291 -0.881 . . . . 0.0 112.511 -173.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -70.37 158.07 36.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.282 1.833 . . . . 0.0 115.629 172.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.48 -22.88 65.48 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -81.31 -3.32 52.22 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.415 1.486 . . . . 0.0 114.632 174.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.95 19.59 46.57 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.631 1.11 . . . . 0.0 115.614 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.3 m -94.6 128.43 41.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 118.969 1.384 . . . . 0.0 111.349 178.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.57 143.86 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.359 1.064 . . . . 0.0 110.213 -174.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -150.71 -172.97 4.33 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.968 1.707 . . . . 0.0 109.759 175.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -124.67 143.7 50.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.064 1.746 . . . . 0.0 110.007 -175.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -140.76 132.7 27.66 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.838 1.255 . . . . 0.0 111.568 -170.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -91.46 120.71 32.52 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.371 0.669 . . . . 0.0 110.685 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -77.13 -20.16 55.96 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -172.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.8 mp -86.06 -40.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.818 1.247 . . . . 0.0 111.741 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 p -108.95 -7.31 15.43 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -170.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.1 m-80 59.91 16.11 5.48 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.521 1.928 . . . . 0.0 114.814 -175.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.54 152.93 44.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.955 0.902 . . . . 0.0 111.837 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.7 p -136.72 148.24 47.2 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.621 1.169 . . . . 0.0 112.265 178.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.2 tp60 -156.25 142.42 18.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.357 1.463 . . . . 0.0 111.348 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.345 53.1 t80 . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 118.815 2.894 . . . . 0.0 118.815 -171.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.372 0 N-CA-C 116.148 1.219 . . . . 0.0 116.148 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -74.85 139.3 43.1 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.767 1.784 . . . . 0.0 114.048 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.85 154.1 36.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.994 1.718 . . . . 0.0 111.108 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -61.97 145.14 53.85 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 175.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpt85 -142.82 163.05 33.85 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.281 2.232 . . . . 0.0 109.468 -175.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 50.8 ttp -154.78 136.1 14.07 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.348 -0.845 . . . . 0.0 112.853 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -70.49 157.72 37.35 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.161 1.784 . . . . 0.0 115.365 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.02 -22.42 65.7 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.6 -3.51 50.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.437 1.495 . . . . 0.0 114.631 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.75 43.71 Favored Glycine 0 CA--C 1.539 1.538 0 C-N-CA 124.6 1.095 . . . . 0.0 115.397 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.1 m -94.59 124.62 38.73 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.948 1.374 . . . . 0.0 111.482 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.4 t -94.75 142.81 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.346 1.059 . . . . 0.0 110.067 -173.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -149.47 -171.86 3.99 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.373 1.869 . . . . 0.0 109.639 176.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -123.59 142.42 51.05 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.668 1.587 . . . . 0.0 109.93 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -136.87 135.22 37.68 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.933 1.293 . . . . 0.0 112.652 -176.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -96.17 114.89 26.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.55 0.74 . . . . 0.0 110.757 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -73.82 -23.63 59.69 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.8 mt -84.8 -40.08 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.336 1.454 . . . . 0.0 111.07 -178.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.93 -7.47 15.42 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.18 1.918 . . . . 0.0 116.18 -171.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.27 15.37 5.29 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.802 2.041 . . . . 0.0 113.923 -175.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.67 155.64 40.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.052 -1.03 . . . . 0.0 112.08 172.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.1 p -141.18 150.03 42.23 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.641 1.176 . . . . 0.0 111.938 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -155.0 139.78 17.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.622 1.169 . . . . 0.0 111.3 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 48.8 t80 . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 169.738 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.34 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -73.76 134.94 43.53 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 120.002 1.901 . . . . 0.0 114.109 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -145.51 162.04 38.33 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.85 2.06 . . . . 0.0 111.444 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -69.8 145.09 52.42 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.442 -0.786 . . . . 0.0 112.994 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -143.24 165.2 28.12 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.291 2.236 . . . . 0.0 109.835 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.2 ttm -154.63 134.25 12.78 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.362 -0.836 . . . . 0.0 112.512 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -71.26 158.58 36.14 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.334 1.853 . . . . 0.0 115.438 172.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.89 -22.44 65.56 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -81.0 -3.66 52.47 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.439 1.496 . . . . 0.0 114.625 174.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.04 22.24 39.19 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.538 1.066 . . . . 0.0 115.331 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.9 m -94.59 126.95 40.21 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.902 1.351 . . . . 0.0 111.116 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.7 t -94.69 142.67 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.195 0.998 . . . . 0.0 109.954 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -151.83 -174.29 4.81 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.947 1.699 . . . . 0.0 108.801 176.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -120.51 143.65 48.44 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.47 1.508 . . . . 0.0 110.637 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -142.66 136.11 28.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.598 1.159 . . . . 0.0 111.561 -172.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -94.77 117.0 29.42 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.252 0.621 . . . . 0.0 110.814 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -72.69 -22.98 60.82 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.3 mt -86.09 -40.08 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.708 1.603 . . . . 0.0 111.102 -177.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -112.12 -3.55 14.67 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.272 1.953 . . . . 0.0 116.272 -170.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.331 15.7 p30 53.69 17.36 1.21 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.89 2.476 . . . . 0.0 115.979 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.2 152.68 44.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.338 1.055 . . . . 0.0 111.931 170.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.6 p -141.02 148.65 40.62 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.8 1.24 . . . . 0.0 112.154 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -158.64 146.27 17.94 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.585 1.154 . . . . 0.0 111.804 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 177.386 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.294 0 N-CA-C 115.795 1.078 . . . . 0.0 115.795 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -75.1 138.97 42.46 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.637 1.718 . . . . 0.0 113.771 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -147.37 165.52 29.94 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.685 1.994 . . . . 0.0 112.054 176.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -65.68 145.19 56.33 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -144.24 162.3 36.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.983 2.113 . . . . 0.0 110.082 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.3 ttp -154.73 137.24 15.07 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.439 -0.788 . . . . 0.0 112.811 -177.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -71.09 157.99 37.24 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.179 1.792 . . . . 0.0 115.461 172.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -23.09 65.88 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 p30 -81.02 -3.19 50.92 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.349 1.46 . . . . 0.0 114.537 174.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.43 19.99 46.87 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.61 1.1 . . . . 0.0 115.5 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.9 m -94.62 126.14 39.72 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.952 1.376 . . . . 0.0 111.344 177.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.0 t -94.65 142.12 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.255 1.022 . . . . 0.0 110.175 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -148.43 -168.73 3.17 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.55 1.94 . . . . 0.0 108.83 174.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -130.32 147.11 51.99 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.512 1.125 . . . . 0.0 109.591 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -142.48 134.59 27.38 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.56 1.544 . . . . 0.0 112.473 -169.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -92.96 116.17 28.8 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.331 0.653 . . . . 0.0 110.875 175.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -73.77 -22.01 59.99 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -176.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.6 mt -86.31 -40.19 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.668 1.587 . . . . 0.0 111.133 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 p -110.39 -6.26 15.01 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -171.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 60.52 14.82 5.12 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.783 2.033 . . . . 0.0 115.239 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.0 152.49 45.19 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.244 1.018 . . . . 0.0 111.984 172.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.1 p -140.38 143.73 35.85 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.925 1.29 . . . . 0.0 112.139 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -155.84 141.72 18.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.418 1.087 . . . . 0.0 111.145 -177.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.254 43.3 t80 . . . . . 0 CA--C 1.538 0.502 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 177.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.305 0 N-CA-C 116.228 1.251 . . . . 0.0 116.228 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -74.09 139.91 44.94 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.866 1.833 . . . . 0.0 114.028 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.04 155.72 38.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.055 1.742 . . . . 0.0 110.606 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.49 145.07 56.58 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.096 -1.002 . . . . 0.0 113.335 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -144.53 162.36 36.78 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.058 2.143 . . . . 0.0 109.648 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.8 ptp -154.82 140.11 17.64 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -72.77 159.12 34.3 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.302 1.841 . . . . 0.0 115.347 174.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.39 -22.77 66.4 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 178.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 p30 -80.27 -0.71 37.66 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.156 1.383 . . . . 0.0 114.491 173.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.12 18.76 55.17 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.664 1.126 . . . . 0.0 115.371 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.9 m -94.73 128.3 41.33 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.678 1.239 . . . . 0.0 110.974 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.3 t -94.7 143.2 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.644 1.178 . . . . 0.0 110.429 -176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -150.49 -173.57 4.5 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.27 1.828 . . . . 0.0 109.036 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -122.54 141.89 51.2 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.172 1.389 . . . . 0.0 110.547 -178.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -136.6 135.5 38.42 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.942 1.297 . . . . 0.0 112.232 -173.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -96.72 115.61 27.73 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.471 0.709 . . . . 0.0 110.739 176.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.36 -22.99 60.15 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -85.47 -40.09 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.001 -178.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.3 p -108.89 -7.14 15.51 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 60.33 13.78 4.23 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.932 2.093 . . . . 0.0 115.288 -175.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.83 153.93 42.66 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.227 1.011 . . . . 0.0 112.272 173.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.5 p -143.17 139.02 30.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.08 1.352 . . . . 0.0 111.876 179.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -154.87 154.11 32.19 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.539 0.735 . . . . 0.0 112.616 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 117.743 2.497 . . . . 0.0 117.743 -178.238 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 119.307 -0.378 . . . . 0.0 111.064 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 19.4 mt -148.15 164.26 22.96 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 126.797 2.039 . . . . 0.0 110.626 -174.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -66.08 168.28 16.05 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.66 2.907 . . . . 0.0 112.851 174.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.32 123.23 12.24 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.817 3.011 . . . . 0.0 114.51 -174.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.64 -17.26 21.32 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.666 1.603 . . . . 0.0 116.26 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -73.99 139.26 44.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.876 1.838 . . . . 0.0 113.909 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -151.37 156.76 41.38 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.609 1.564 . . . . 0.0 111.169 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.92 145.19 53.59 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 173.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 tpt85 -142.66 165.31 27.74 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.364 2.266 . . . . 0.0 109.613 -175.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.3 ttm -154.7 134.76 13.07 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.552 -0.718 . . . . 0.0 112.521 -175.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.1 158.55 35.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.32 1.848 . . . . 0.0 115.857 173.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.66 -22.92 65.71 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.7 p30 -80.97 -3.08 50.39 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.381 1.472 . . . . 0.0 114.566 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.96 19.93 48.87 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.745 1.164 . . . . 0.0 115.501 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.0 m -94.58 130.13 41.14 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 118.961 1.38 . . . . 0.0 111.231 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.76 143.16 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.408 1.083 . . . . 0.0 110.104 -176.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -151.25 -172.52 4.23 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.155 1.782 . . . . 0.0 108.834 175.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -123.47 141.85 51.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.323 1.449 . . . . 0.0 110.577 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -135.79 134.97 39.51 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.012 1.325 . . . . 0.0 112.566 -174.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -95.94 115.43 27.41 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.47 0.708 . . . . 0.0 110.671 176.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.46 -23.69 60.12 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.3 mt -84.61 -40.25 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.467 1.507 . . . . 0.0 111.086 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 p -109.21 -6.92 15.38 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -171.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.18 16.25 5.9 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 127.007 2.123 . . . . 0.0 113.932 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.21 154.36 41.07 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.053 -1.029 . . . . 0.0 112.059 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.2 p -143.76 138.53 28.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.889 1.276 . . . . 0.0 111.696 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -154.99 154.11 32.04 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -85.63 -37.03 19.95 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -177.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -82.75 149.35 27.31 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.723 1.209 . . . . 0.0 110.898 174.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -60.29 125.66 82.23 Favored Pre-proline 0 CA--C 1.548 0.902 0 O-C-N 121.2 -0.938 . . . . 0.0 111.813 -176.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -57.92 153.78 42.38 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 124.27 3.313 . . . . 0.0 113.307 176.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.2 m -146.93 153.97 40.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.036 1.334 . . . . 0.0 112.073 -175.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.222 0 C-N-CA 125.141 1.353 . . . . 0.0 112.946 -178.348 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 111.47 0.174 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.2 mt -135.22 163.03 53.92 Favored Pre-proline 0 CA--C 1.551 1.0 0 C-N-CA 126.508 1.923 . . . . 0.0 110.891 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -67.14 170.47 13.11 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.25 2.633 . . . . 0.0 113.015 177.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -52.6 123.5 13.02 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.595 2.863 . . . . 0.0 114.37 -175.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.19 -15.71 21.04 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 125.632 1.587 . . . . 0.0 116.134 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -75.22 137.5 41.29 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.75 1.775 . . . . 0.0 113.919 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -141.73 157.32 45.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.754 2.021 . . . . 0.0 111.106 174.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -68.85 145.11 54.0 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.399 -0.813 . . . . 0.0 112.783 169.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 -144.62 162.61 36.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.15 2.18 . . . . 0.0 109.59 -177.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.7 ptm -154.84 140.26 17.76 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -178.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -71.07 156.57 39.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.329 1.852 . . . . 0.0 114.986 172.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.86 -21.93 66.32 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -78.48 -3.21 42.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.098 1.359 . . . . 0.0 114.472 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.98 18.55 46.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.709 1.147 . . . . 0.0 115.416 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.64 127.37 40.55 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 118.914 1.357 . . . . 0.0 111.61 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.77 143.32 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.672 1.189 . . . . 0.0 110.371 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -150.28 -175.23 5.0 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.252 1.821 . . . . 0.0 109.172 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -120.54 143.88 48.35 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.13 1.372 . . . . 0.0 109.953 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -137.82 134.21 34.9 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.062 1.345 . . . . 0.0 112.14 -176.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -94.37 115.05 27.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.58 0.752 . . . . 0.0 110.78 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -73.64 -22.78 59.88 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -85.9 -40.17 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.427 1.491 . . . . 0.0 111.122 -178.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.6 p -109.32 -7.15 15.28 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 60.43 13.42 4.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.935 2.094 . . . . 0.0 115.306 -175.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.87 155.51 40.45 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.22 1.008 . . . . 0.0 112.272 172.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.8 p -138.35 150.06 46.21 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.044 1.338 . . . . 0.0 111.767 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -153.84 142.05 20.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.247 1.019 . . . . 0.0 110.987 -174.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -84.51 -41.1 16.87 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 172.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.1 mp0 -73.4 157.78 36.25 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.064 1.746 . . . . 0.0 111.075 169.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -59.12 118.63 31.5 Favored Pre-proline 0 N--CA 1.476 0.84 0 CA-C-O 118.342 -0.837 . . . . 0.0 108.919 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.61 144.3 97.47 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.121 2.547 . . . . 0.0 112.166 -174.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.6 m 50.74 57.82 6.21 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.83 1.252 . . . . 0.0 112.674 -171.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.242 0 C-N-CA 125.453 1.501 . . . . 0.0 113.707 -179.341 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 77.6 tttt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 119.868 -0.11 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 49.4 mt -133.63 162.06 59.94 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 126.159 1.784 . . . . 0.0 111.495 -175.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.06 171.87 12.94 Favored 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 123.922 3.081 . . . . 0.0 113.108 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -53.13 129.15 32.02 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.61 2.873 . . . . 0.0 114.179 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.48 -19.82 6.72 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 125.536 1.541 . . . . 0.0 116.041 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -76.08 136.73 39.88 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.465 1.632 . . . . 0.0 114.436 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -155.07 144.55 21.26 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.905 1.282 . . . . 0.0 111.579 169.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -58.11 145.16 37.72 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.265 1.426 . . . . 0.0 113.519 177.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.43 170.92 15.04 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 127.093 2.157 . . . . 0.0 110.788 -171.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.0 tpp -154.63 129.8 9.62 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.971 0.908 . . . . 0.0 112.153 -169.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -80.01 156.67 27.05 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 171.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.99 65.99 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -82.12 -0.29 44.06 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 125.363 1.465 . . . . 0.0 114.564 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.25 19.64 54.68 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.485 1.041 . . . . 0.0 115.274 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.7 m -94.72 132.14 39.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.747 1.219 . . . . 0.0 112.066 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -94.69 143.14 12.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 124.362 1.065 . . . . 0.0 109.228 -177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -147.79 179.97 7.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.861 1.264 . . . . 0.0 110.378 173.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -119.48 139.29 52.32 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.537 1.935 . . . . 0.0 109.534 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -140.34 139.75 35.46 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.249 0.62 . . . . 0.0 112.296 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -100.64 115.52 30.39 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.273 1.029 . . . . 0.0 110.648 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -73.48 -22.22 60.21 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -86.55 -40.16 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 125.409 1.484 . . . . 0.0 111.134 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.8 p -109.77 -7.38 15.05 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 60.54 13.56 4.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.836 2.055 . . . . 0.0 115.391 -176.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.74 153.02 43.95 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.318 1.047 . . . . 0.0 112.157 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.7 p -142.88 149.97 39.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.753 1.221 . . . . 0.0 112.78 178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -149.18 151.66 34.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.803 1.641 . . . . 0.0 112.598 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -84.86 -21.82 29.65 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 169.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -110.07 155.85 21.32 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.533 1.533 . . . . 0.0 110.942 169.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -63.57 148.23 94.32 Favored Pre-proline 0 N--CA 1.474 0.743 0 O-C-N 121.396 -0.815 . . . . 0.0 112.735 -175.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -67.82 150.86 78.89 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.49 2.793 . . . . 0.0 112.195 174.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.6 p -71.01 157.13 38.75 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.393 1.077 . . . . 0.0 113.127 175.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.156 0 C-N-CA 125.131 1.348 . . . . 0.0 112.81 -179.053 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.7 tttt . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 119.436 -0.316 . . . . 0.0 110.928 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.8 mp -71.23 154.39 93.84 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 124.729 1.212 . . . . 0.0 110.844 169.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -68.6 165.85 27.92 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.77 2.98 . . . . 0.0 112.614 173.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -53.94 135.66 64.12 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.762 2.974 . . . . 0.0 114.673 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.69 -22.39 4.09 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.57 1.557 . . . . 0.0 115.809 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -78.89 142.72 36.55 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.496 1.648 . . . . 0.0 113.947 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -152.23 152.09 31.78 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.534 1.934 . . . . 0.0 111.375 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -64.09 145.05 56.6 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.146 -0.971 . . . . 0.0 113.384 174.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.78 164.71 29.37 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.835 2.054 . . . . 0.0 109.968 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.2 ttp -154.74 137.06 14.9 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.528 -0.732 . . . . 0.0 112.64 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -71.54 158.09 36.84 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.186 1.794 . . . . 0.0 115.632 171.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.62 65.98 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -80.14 -3.4 48.72 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.362 1.465 . . . . 0.0 114.471 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.62 21.27 44.41 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.547 1.07 . . . . 0.0 115.382 -177.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.9 m -94.62 124.37 38.61 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.938 1.369 . . . . 0.0 111.249 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.7 t -94.69 142.78 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.274 1.029 . . . . 0.0 110.015 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -149.57 -174.35 4.66 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.117 1.767 . . . . 0.0 109.798 176.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -125.46 142.76 51.33 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.17 1.388 . . . . 0.0 109.871 -176.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.9 133.77 29.04 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.904 1.282 . . . . 0.0 112.8 -169.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -93.41 117.55 30.22 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.271 0.628 . . . . 0.0 110.842 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -74.72 -21.79 59.17 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.4 mt -85.4 -40.13 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.7 1.6 . . . . 0.0 110.987 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.9 p -110.71 -6.47 14.8 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -172.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 60.75 14.9 5.41 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.785 2.034 . . . . 0.0 115.235 -176.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.24 152.42 45.08 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.235 1.014 . . . . 0.0 112.099 172.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.2 p -141.19 147.28 38.1 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.721 1.209 . . . . 0.0 112.009 177.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -157.4 154.4 28.79 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.989 0.915 . . . . 0.0 112.465 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -84.29 -30.83 25.27 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 118.441 2.756 . . . . 0.0 118.441 -177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -90.1 153.87 20.22 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.872 1.269 . . . . 0.0 111.983 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.1 122.96 80.53 Favored Pre-proline 0 N--CA 1.478 0.963 0 O-C-N 121.323 -0.861 . . . . 0.0 110.914 -176.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.17 155.44 67.87 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.149 2.566 . . . . 0.0 112.388 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.6 t -151.64 153.02 33.64 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.072 1.349 . . . . 0.0 111.512 178.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.135 0 C-N-CA 125.521 1.534 . . . . 0.0 112.912 -176.634 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.1 tptm . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.561 0.22 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.73 156.53 12.23 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 126.081 1.753 . . . . 0.0 112.773 174.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -66.64 166.25 22.72 Favored 'Trans proline' 0 CA--C 1.549 1.244 0 C-N-CA 123.816 3.011 . . . . 0.0 112.828 177.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -53.26 139.62 63.28 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.646 2.897 . . . . 0.0 114.323 -178.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.9 -29.47 2.1 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.527 1.537 . . . . 0.0 115.227 -176.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -81.04 141.72 34.08 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.958 1.379 . . . . 0.0 114.171 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.55 158.32 42.33 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.52 1.528 . . . . 0.0 111.312 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -60.81 145.16 50.88 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 171.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -145.06 162.68 36.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.024 2.129 . . . . 0.0 109.819 -177.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 56.4 ttp -154.82 135.92 13.89 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.417 -0.802 . . . . 0.0 112.649 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -72.37 159.83 33.36 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 115.867 1.802 . . . . 0.0 115.867 174.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -23.26 66.21 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -81.42 -0.5 41.79 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.213 1.405 . . . . 0.0 114.417 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.95 19.47 55.87 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.695 1.14 . . . . 0.0 115.245 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.0 m -94.65 125.59 39.4 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 118.777 1.288 . . . . 0.0 110.632 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.5 t -94.69 141.93 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.422 1.089 . . . . 0.0 109.951 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.8 p90 -150.91 -172.47 4.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.38 1.872 . . . . 0.0 108.417 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -125.78 144.87 50.45 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.57 1.148 . . . . 0.0 108.865 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -140.75 136.44 32.52 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.067 1.347 . . . . 0.0 112.26 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -93.87 115.33 27.71 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.758 0.823 . . . . 0.0 110.487 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -73.51 -21.99 60.24 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.1 mt -86.2 -40.04 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.745 1.618 . . . . 0.0 111.074 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -111.28 -7.13 14.44 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -171.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 60.84 13.75 4.68 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.746 2.018 . . . . 0.0 115.193 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.99 155.54 40.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.149 0.98 . . . . 0.0 112.057 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.7 p -141.93 148.97 39.53 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.699 1.2 . . . . 0.0 112.237 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -150.8 139.8 21.02 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.212 1.405 . . . . 0.0 112.915 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -80.15 -28.46 38.84 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -86.43 148.7 25.44 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.668 1.587 . . . . 0.0 111.73 172.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.3 mmm-85 -57.38 120.88 43.69 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 124.528 1.131 . . . . 0.0 111.406 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.08 151.47 67.28 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.716 2.277 . . . . 0.0 111.25 171.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.4 p -148.67 160.72 42.89 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.089 1.356 . . . . 0.0 112.41 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.157 0 C-N-CA 125.237 1.399 . . . . 0.0 113.071 -179.408 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.4 tttt . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 119.305 -0.378 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 42.9 mt -150.02 164.41 20.8 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 126.772 2.029 . . . . 0.0 110.75 -172.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -67.64 169.45 15.88 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 123.76 2.973 . . . . 0.0 112.947 174.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -53.5 129.28 33.0 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.561 2.841 . . . . 0.0 113.987 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.52 -18.73 10.36 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.538 1.542 . . . . 0.0 116.119 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -74.43 137.8 42.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.645 1.722 . . . . 0.0 114.247 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -153.49 153.5 32.56 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.39 1.876 . . . . 0.0 111.104 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -66.42 145.04 56.13 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 175.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -143.1 162.99 34.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.187 2.195 . . . . 0.0 109.517 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.5 ttp -154.72 136.39 14.37 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 112.668 -175.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -71.7 157.91 37.09 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.102 1.761 . . . . 0.0 115.628 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.18 -22.34 65.82 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -80.15 -3.19 47.9 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.323 1.449 . . . . 0.0 114.427 173.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.34 21.78 43.46 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 124.595 1.093 . . . . 0.0 115.322 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -94.64 123.32 38.01 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 118.798 1.299 . . . . 0.0 111.3 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.79 142.56 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.406 1.083 . . . . 0.0 109.683 -175.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -151.05 -175.74 5.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.073 1.749 . . . . 0.0 109.545 177.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -119.65 141.57 49.22 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.654 1.582 . . . . 0.0 110.949 -177.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -139.06 135.81 34.59 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.742 1.217 . . . . 0.0 112.223 -173.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -96.59 115.25 27.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.554 0.742 . . . . 0.0 110.653 176.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.04 -22.61 60.59 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.9 mt -85.76 -40.07 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 125.454 1.502 . . . . 0.0 110.986 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.0 p -109.48 -7.32 15.19 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.175 1.916 . . . . 0.0 116.175 -171.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.52 13.49 4.21 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.936 2.094 . . . . 0.0 115.298 -175.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.21 153.33 43.85 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.187 0.995 . . . . 0.0 112.258 173.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 86.9 p -138.72 148.87 44.45 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.893 1.277 . . . . 0.0 112.052 176.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -157.61 145.91 19.15 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.674 1.19 . . . . 0.0 112.004 -175.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -89.72 -44.48 9.98 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -75.1 122.87 24.23 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.102 0.961 . . . . 0.0 110.302 174.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -58.74 136.15 86.71 Favored Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -169.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -62.69 154.92 62.28 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.319 2.679 . . . . 0.0 112.38 171.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.9 t -70.58 137.47 50.07 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.458 -0.776 . . . . 0.0 111.903 176.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.276 0 CA-C-O 117.163 -1.91 . . . . 0.0 114.69 179.414 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 119.611 -0.233 . . . . 0.0 111.503 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 46.5 mt -134.85 162.72 56.02 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.719 2.008 . . . . 0.0 111.132 -178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -66.97 168.97 15.85 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 123.729 2.952 . . . . 0.0 112.955 175.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -52.41 126.84 21.9 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.565 2.844 . . . . 0.0 113.948 -178.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.36 -21.58 7.09 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 125.591 1.567 . . . . 0.0 116.122 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -73.21 133.24 43.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.875 1.838 . . . . 0.0 113.836 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -144.23 161.69 38.25 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.511 1.924 . . . . 0.0 111.484 173.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -65.49 145.2 56.42 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -143.78 164.09 31.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.216 2.206 . . . . 0.0 109.585 -175.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 77.1 mtm -154.45 136.9 15.0 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -79.6 156.42 27.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.296 1.838 . . . . 0.0 115.441 172.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.34 66.44 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.2 p30 -79.91 -2.95 45.97 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.337 1.455 . . . . 0.0 114.58 174.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.29 20.9 43.4 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.548 1.071 . . . . 0.0 115.444 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.7 m -94.63 134.58 37.05 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.788 1.294 . . . . 0.0 111.63 177.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.7 t -94.71 141.55 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.996 1.318 . . . . 0.0 110.961 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.37 -172.11 4.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.494 1.517 . . . . 0.0 108.718 172.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.38 142.29 51.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.662 1.585 . . . . 0.0 110.392 -176.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.37 134.94 31.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.604 1.161 . . . . 0.0 112.525 -172.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -95.47 113.66 25.35 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.784 0.833 . . . . 0.0 110.614 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -72.53 -22.06 61.09 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.5 -40.11 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.482 1.513 . . . . 0.0 111.062 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -109.51 -6.9 15.25 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 116.177 1.918 . . . . 0.0 116.177 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.62 13.58 4.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.886 2.074 . . . . 0.0 115.276 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.57 153.63 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.158 0.983 . . . . 0.0 112.256 172.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.8 p -140.44 147.0 39.01 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.009 1.324 . . . . 0.0 112.026 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -154.13 143.61 21.52 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.839 0.856 . . . . 0.0 111.915 -175.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -83.56 -38.7 21.33 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 175.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -79.81 152.3 29.81 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.294 0.638 . . . . 0.0 109.815 169.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -70.12 137.48 87.01 Favored Pre-proline 0 CA--C 1.542 0.642 0 O-C-N 121.574 -0.704 . . . . 0.0 111.903 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -60.05 148.22 90.02 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.483 2.788 . . . . 0.0 111.847 169.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.7 p 48.45 38.03 10.05 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 126.214 1.806 . . . . 0.0 115.4 177.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.29 0 C-N-CA 125.059 1.314 . . . . 0.0 113.896 178.4 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 N--CA 1.488 1.429 0 N-CA-C 111.536 0.198 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 17.9 mt -135.08 164.46 43.76 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 126.687 1.995 . . . . 0.0 111.368 -173.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -66.35 169.67 13.54 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.603 2.868 . . . . 0.0 112.859 176.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -51.74 121.66 9.02 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.741 2.961 . . . . 0.0 114.451 -174.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.82 -17.16 22.87 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 125.712 1.625 . . . . 0.0 116.161 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -73.36 139.0 45.69 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.88 1.84 . . . . 0.0 114.209 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.63 152.71 33.2 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.942 1.697 . . . . 0.0 111.42 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -63.72 145.12 56.35 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -146.08 162.18 38.49 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.577 1.951 . . . . 0.0 109.655 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.4 ptm -154.87 140.25 17.72 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.33 156.02 40.0 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.1 1.76 . . . . 0.0 114.885 172.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.06 -21.48 66.19 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -78.29 -3.47 43.08 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.187 1.395 . . . . 0.0 114.435 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.65 20.2 41.5 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 124.601 1.096 . . . . 0.0 115.199 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.2 m -94.62 125.08 39.04 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.867 1.333 . . . . 0.0 111.592 177.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.1 t -94.74 142.49 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.539 1.136 . . . . 0.0 110.348 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -149.46 -172.59 4.17 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.372 1.869 . . . . 0.0 109.359 175.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -127.54 144.16 51.1 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.476 1.511 . . . . 0.0 110.321 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -135.98 137.09 40.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.904 1.281 . . . . 0.0 111.247 -176.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -97.42 115.76 28.36 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.465 0.706 . . . . 0.0 110.85 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -72.89 -24.09 60.81 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.55 -40.23 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.479 1.512 . . . . 0.0 111.089 -178.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.8 p -110.15 -3.53 16.3 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -170.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.319 16.3 p30 53.84 15.04 0.74 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 128.271 2.628 . . . . 0.0 116.071 -174.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.27 156.22 39.11 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.62 1.168 . . . . 0.0 112.308 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.6 p -136.76 149.64 47.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.797 1.239 . . . . 0.0 111.763 173.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -155.8 145.38 21.07 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.539 1.136 . . . . 0.0 111.584 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -89.56 -38.69 13.79 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -76.8 134.9 38.96 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.433 1.093 . . . . 0.0 111.722 175.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.92 110.23 2.05 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.401 1.481 . . . . 0.0 112.312 -174.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -60.87 147.83 94.17 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.886 3.058 . . . . 0.0 115.733 -169.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.5 t -150.21 154.65 38.33 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.94 1.296 . . . . 0.0 111.491 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.144 0 C-N-CA 125.513 1.53 . . . . 0.0 112.805 -177.427 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 tptm . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 110.604 -0.146 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.48 149.28 61.56 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.356 1.462 . . . . 0.0 112.12 177.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -69.72 166.7 26.65 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.28 3.32 . . . . 0.0 112.419 172.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -54.26 140.06 72.46 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.832 3.021 . . . . 0.0 114.446 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.27 -24.65 3.45 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 125.578 1.561 . . . . 0.0 115.564 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -79.81 146.12 32.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.223 1.511 . . . . 0.0 114.107 177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -145.6 157.99 43.9 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.158 2.183 . . . . 0.0 111.581 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -75.75 145.12 41.05 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.774 -0.579 . . . . 0.0 111.347 169.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -146.9 164.29 33.37 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.525 1.53 . . . . 0.0 110.103 -177.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.1 ttm -154.66 135.59 13.76 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.383 -0.823 . . . . 0.0 112.552 -171.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -72.25 158.13 36.42 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.39 1.876 . . . . 0.0 115.6 172.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.21 65.38 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.87 -3.33 50.91 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.424 1.49 . . . . 0.0 114.55 174.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.8 20.92 45.09 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.658 1.123 . . . . 0.0 115.443 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.57 128.55 41.27 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 118.916 1.358 . . . . 0.0 111.289 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.3 t -94.71 142.86 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.185 0.994 . . . . 0.0 110.039 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -148.66 -175.29 4.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.336 1.854 . . . . 0.0 109.274 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -125.2 143.88 50.73 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.179 1.392 . . . . 0.0 110.277 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -141.49 136.93 31.72 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.466 1.107 . . . . 0.0 110.494 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -96.24 119.1 34.13 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.536 0.735 . . . . 0.0 111.081 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -73.75 -23.52 59.76 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.0 mt -84.24 -40.23 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.852 1.661 . . . . 0.0 111.016 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -112.7 -3.01 14.34 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -170.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.327 15.8 p30 53.87 16.84 1.15 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.933 2.493 . . . . 0.0 116.046 -174.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.51 154.75 39.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.417 1.087 . . . . 0.0 111.906 171.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.2 p -144.49 146.57 32.49 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.361 1.064 . . . . 0.0 112.087 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -157.71 156.13 31.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.102 0.961 . . . . 0.0 112.3 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -85.4 -28.72 24.94 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 118.499 2.778 . . . . 0.0 118.499 -177.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -92.37 153.07 19.41 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.949 1.3 . . . . 0.0 112.162 176.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.2 ttp180 -62.82 124.4 83.27 Favored Pre-proline 0 N--CA 1.476 0.87 0 O-C-N 121.375 -0.828 . . . . 0.0 111.329 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -63.28 160.21 36.01 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.579 2.853 . . . . 0.0 114.027 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.9 p -149.04 158.97 44.6 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.329 1.451 . . . . 0.0 112.334 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.219 0 C-N-CA 125.36 1.457 . . . . 0.0 113.342 -177.093 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.5 tptt . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.747 0.308 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 44.2 mt -58.25 162.82 5.33 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 126.23 1.812 . . . . 0.0 113.331 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -66.71 170.91 11.68 Favored 'Trans proline' 0 CA--C 1.549 1.229 0 C-N-CA 123.559 2.839 . . . . 0.0 113.108 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -51.57 121.81 9.18 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.737 2.958 . . . . 0.0 114.636 -174.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.8 -16.09 22.45 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 125.682 1.61 . . . . 0.0 116.154 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -73.56 140.12 46.07 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.918 1.859 . . . . 0.0 114.189 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -149.46 154.79 39.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.674 1.59 . . . . 0.0 110.693 174.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -64.13 145.1 56.52 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 173.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -144.18 163.64 33.02 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.16 2.184 . . . . 0.0 109.651 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 54.1 ttp -154.71 136.33 14.33 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.205 -0.934 . . . . 0.0 112.696 -176.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -72.1 158.04 36.66 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.194 1.798 . . . . 0.0 115.792 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.07 -22.94 66.18 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.4 p30 -80.09 -2.94 46.61 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.302 1.441 . . . . 0.0 114.43 173.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.52 20.61 47.42 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.745 1.164 . . . . 0.0 115.4 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 54.4 m -94.63 124.78 38.87 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 118.941 1.371 . . . . 0.0 111.043 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -94.64 141.91 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.391 1.076 . . . . 0.0 109.395 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.76 -170.32 3.62 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.201 1.8 . . . . 0.0 108.403 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -126.02 143.97 50.9 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.445 1.498 . . . . 0.0 110.163 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -135.69 134.88 39.61 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.163 1.385 . . . . 0.0 112.098 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -95.61 115.22 27.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.436 0.694 . . . . 0.0 110.69 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -73.41 -23.21 60.11 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -85.1 -40.1 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.371 1.468 . . . . 0.0 111.101 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.0 p -108.74 -7.36 15.59 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 60.26 13.64 4.08 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.005 2.122 . . . . 0.0 115.357 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.71 154.53 41.29 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.364 1.065 . . . . 0.0 112.404 173.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -132.95 148.33 52.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.166 1.387 . . . . 0.0 111.689 173.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -156.75 143.19 18.3 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.588 1.155 . . . . 0.0 112.0 -170.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.267 63.4 m-85 -89.86 -56.41 3.25 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 118.604 2.816 . . . . 0.0 118.604 -175.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -74.08 155.0 38.95 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.313 1.045 . . . . 0.0 111.106 171.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -54.96 118.49 17.59 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 124.515 1.126 . . . . 0.0 110.885 -173.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -54.78 137.47 74.81 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 123.823 3.016 . . . . 0.0 113.284 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.8 m 50.86 57.54 6.53 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.732 1.213 . . . . 0.0 112.739 -171.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.268 0 C-N-CA 125.473 1.511 . . . . 0.0 113.711 -178.901 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.4 mt 60.58 165.03 0.1 OUTLIER Pre-proline 0 CA--C 1.557 1.239 0 C-N-CA 127.378 2.271 . . . . 0.0 114.953 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -68.1 168.76 18.19 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 C-N-CA 123.17 2.58 . . . . 0.0 112.546 173.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -52.81 123.19 12.44 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.643 2.895 . . . . 0.0 114.285 -175.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.58 -16.92 22.72 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.538 1.542 . . . . 0.0 116.262 179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -73.83 140.31 45.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.94 1.87 . . . . 0.0 114.175 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -152.27 150.46 29.8 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.403 1.881 . . . . 0.0 111.238 178.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -66.95 145.05 55.83 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.69 167.09 22.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 127.262 2.225 . . . . 0.0 110.05 -175.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.3 ttm -154.72 134.57 12.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.617 -0.677 . . . . 0.0 112.574 -174.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -71.29 158.55 36.17 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.47 1.908 . . . . 0.0 115.994 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.47 -23.04 65.6 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.3 p30 -81.3 -2.73 50.16 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.278 1.431 . . . . 0.0 114.515 174.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.74 19.75 50.27 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.731 1.158 . . . . 0.0 115.511 -178.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 59.9 m -94.7 131.07 40.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 118.995 1.397 . . . . 0.0 111.253 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.4 t -94.65 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.337 1.055 . . . . 0.0 109.986 -176.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.3 -176.17 5.27 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.949 1.7 . . . . 0.0 109.536 174.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.53 144.69 48.57 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.703 1.601 . . . . 0.0 110.237 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -139.36 135.72 34.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.898 1.279 . . . . 0.0 111.968 -175.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -97.02 116.77 29.81 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.283 0.633 . . . . 0.0 110.799 175.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -74.01 -22.95 59.39 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -176.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.9 mt -85.06 -40.17 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.502 1.521 . . . . 0.0 110.989 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.0 p -110.18 -6.12 15.15 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -171.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 60.17 14.76 4.74 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.796 2.038 . . . . 0.0 115.267 -175.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.56 152.27 45.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.211 1.004 . . . . 0.0 112.183 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.0 p -140.24 142.26 35.82 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.981 1.312 . . . . 0.0 111.914 177.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -155.08 146.39 22.91 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.181 0.993 . . . . 0.0 111.915 -174.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -84.9 -40.18 17.34 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 176.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.13 151.57 41.52 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.958 1.303 . . . . 0.0 111.942 170.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -61.01 125.21 83.14 Favored Pre-proline 0 CA--C 1.548 0.866 0 O-C-N 121.273 -0.892 . . . . 0.0 110.199 177.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -53.25 137.95 63.91 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.954 3.103 . . . . 0.0 113.647 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.5 t -69.14 133.36 47.91 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.978 0.911 . . . . 0.0 112.808 -171.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.24 0 C-N-CA 125.577 1.56 . . . . 0.0 112.769 -176.318 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 119.486 -0.292 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.2 mp 60.88 143.4 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.257 0 C-N-CA 128.898 2.879 . . . . 0.0 114.263 -175.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -77.23 167.57 24.53 Favored 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 123.864 3.042 . . . . 0.0 111.865 172.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -54.42 137.98 72.93 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.571 2.847 . . . . 0.0 114.587 -175.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.25 -24.69 5.32 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 125.541 1.543 . . . . 0.0 115.653 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -76.9 140.96 40.71 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 119.461 1.631 . . . . 0.0 113.785 178.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -153.48 154.38 34.27 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.945 1.698 . . . . 0.0 111.438 176.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -57.01 145.36 30.69 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -146.93 164.34 33.25 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.685 1.994 . . . . 0.0 110.5 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 53.1 ttp -154.79 135.84 13.86 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.61 -0.681 . . . . 0.0 112.615 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -71.05 158.15 36.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.192 1.797 . . . . 0.0 115.65 172.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.98 65.99 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.2 p30 -80.36 -3.08 48.18 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.349 1.46 . . . . 0.0 114.455 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.01 20.07 48.09 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.737 1.16 . . . . 0.0 115.416 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 56.1 m -94.68 126.11 39.77 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 119.026 1.413 . . . . 0.0 111.16 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.5 t -94.68 142.26 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.279 1.031 . . . . 0.0 109.85 -174.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -150.34 -173.05 4.33 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.192 1.797 . . . . 0.0 109.032 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -128.16 141.73 51.39 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.38 1.472 . . . . 0.0 109.034 -175.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -137.98 134.16 34.55 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.831 1.253 . . . . 0.0 112.126 -170.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -92.97 114.73 27.37 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 110.678 177.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.03 -22.67 60.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.7 mt -85.13 -40.18 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 111.056 -177.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 p -111.76 -6.81 14.27 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -171.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 60.76 14.13 4.87 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.766 2.026 . . . . 0.0 115.193 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.95 155.57 39.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.088 0.955 . . . . 0.0 112.217 172.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 70.8 p -141.91 145.32 34.43 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.868 1.267 . . . . 0.0 111.993 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -152.14 142.72 22.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.297 1.039 . . . . 0.0 111.703 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -79.99 -36.0 36.62 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 117.167 2.284 . . . . 0.0 117.167 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -80.85 146.43 30.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.222 1.409 . . . . 0.0 111.826 172.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.45 119.27 58.35 Favored Pre-proline 0 N--CA 1.474 0.725 0 C-N-CA 123.799 0.84 . . . . 0.0 110.218 179.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.59 144.83 50.65 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.631 2.221 . . . . 0.0 112.116 -176.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.8 m -72.26 129.87 39.46 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.943 1.297 . . . . 0.0 113.806 -172.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.397 0 C-N-CA 126.174 1.845 . . . . 0.0 114.005 -177.518 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.1 tmmm? . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 119.384 -0.341 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 24.7 mt -127.9 162.97 46.46 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 126.302 1.841 . . . . 0.0 110.745 171.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -65.21 167.53 16.17 Favored 'Trans proline' 0 CA--C 1.548 1.223 0 C-N-CA 123.292 2.661 . . . . 0.0 113.013 176.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -52.51 122.41 10.78 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.647 2.898 . . . . 0.0 114.169 -175.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.61 -17.5 19.91 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 125.58 1.562 . . . . 0.0 116.15 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -73.66 135.79 43.78 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.943 1.872 . . . . 0.0 113.832 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -145.66 163.75 33.89 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.904 1.682 . . . . 0.0 112.243 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.43 145.12 56.59 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 172.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -143.5 161.67 37.83 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.213 2.205 . . . . 0.0 109.769 -176.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.7 ttt -154.77 131.37 10.6 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -171.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -77.69 155.09 31.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.589 1.955 . . . . 0.0 115.514 175.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -22.36 66.82 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -79.94 -0.79 36.58 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.61 13.14 56.02 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 124.701 1.144 . . . . 0.0 115.418 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 30.9 m -94.68 127.56 40.75 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.863 1.331 . . . . 0.0 112.343 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.79 142.98 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.475 1.11 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -149.62 -169.02 3.27 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.328 1.851 . . . . 0.0 108.83 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -127.46 145.37 50.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.573 1.549 . . . . 0.0 110.429 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -141.2 134.63 29.79 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.107 1.363 . . . . 0.0 112.241 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -94.73 115.78 27.94 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.726 176.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.71 -22.42 59.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.6 mt -85.68 -40.13 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.508 1.523 . . . . 0.0 111.08 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -110.49 -6.02 15.01 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -171.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.35 14.66 4.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.819 2.047 . . . . 0.0 115.302 -176.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.75 152.51 45.23 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.146 0.979 . . . . 0.0 112.161 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 56.6 p -139.8 144.24 37.26 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.99 1.316 . . . . 0.0 111.986 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -156.79 143.76 18.66 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.455 1.102 . . . . 0.0 111.049 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.253 43.3 t80 -85.19 -39.22 18.08 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 177.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.91 141.64 51.15 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.332 1.053 . . . . 0.0 112.225 171.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.34 116.03 20.1 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.273 1.029 . . . . 0.0 111.895 -177.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -59.44 126.17 20.0 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.563 2.842 . . . . 0.0 114.77 -171.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 56.3 m 53.9 40.91 32.09 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.532 1.533 . . . . 0.0 114.928 175.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 CA-C-O 118.223 -1.32 . . . . 0.0 113.769 176.71 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 25.7 mt -124.3 163.64 34.9 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.376 1.871 . . . . 0.0 111.569 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -67.04 170.15 13.6 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 C-N-CA 123.917 3.078 . . . . 0.0 112.835 174.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -52.68 127.81 25.88 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.678 2.919 . . . . 0.0 114.035 -177.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.69 -21.27 5.56 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.592 1.567 . . . . 0.0 116.075 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -73.72 138.23 44.51 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.72 1.76 . . . . 0.0 113.943 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.72 154.7 36.82 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.157 1.783 . . . . 0.0 111.205 175.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -62.55 145.02 55.39 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -144.11 163.54 33.28 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.169 2.188 . . . . 0.0 109.74 -176.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.1 ttm -154.71 135.06 13.28 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.412 -0.805 . . . . 0.0 112.521 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -71.25 158.14 36.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.271 1.828 . . . . 0.0 115.81 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -22.57 65.42 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.83 -3.32 50.72 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.396 1.478 . . . . 0.0 114.505 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.83 21.03 44.5 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 124.721 1.153 . . . . 0.0 115.448 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.2 m -94.61 127.03 40.29 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.999 1.4 . . . . 0.0 111.237 178.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.6 t -94.65 142.96 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.431 1.092 . . . . 0.0 110.359 -176.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -151.39 -175.61 5.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.114 1.765 . . . . 0.0 109.199 175.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -118.93 142.67 47.56 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.955 1.302 . . . . 0.0 110.351 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -135.94 134.59 38.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.243 1.417 . . . . 0.0 112.706 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -96.31 114.62 26.32 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.432 0.693 . . . . 0.0 110.77 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -73.41 -22.84 60.13 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.6 mt -85.14 -40.16 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.357 1.463 . . . . 0.0 111.048 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 p -108.62 -7.04 15.76 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -172.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.41 13.29 3.98 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.922 2.089 . . . . 0.0 115.313 -175.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.66 152.63 45.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.055 0.942 . . . . 0.0 112.116 173.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.1 p -138.8 145.46 40.14 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.6 1.16 . . . . 0.0 111.482 174.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -157.05 143.81 18.4 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.092 0.957 . . . . 0.0 112.286 -174.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -84.71 -38.26 19.94 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 176.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -69.32 150.45 47.34 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.515 1.126 . . . . 0.0 111.786 171.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.98 123.45 80.09 Favored Pre-proline 0 N--CA 1.476 0.871 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.774 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -61.51 157.18 42.73 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.201 2.601 . . . . 0.0 113.165 172.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.2 m -158.12 154.66 27.83 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.507 1.523 . . . . 0.0 112.368 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.165 0 C-N-CA 125.144 1.354 . . . . 0.0 112.774 -179.637 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 66.7 mt -128.2 161.39 56.65 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 126.014 1.726 . . . . 0.0 111.834 -172.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -67.58 170.16 14.34 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.574 2.849 . . . . 0.0 112.805 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -52.09 122.87 11.33 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.7 2.933 . . . . 0.0 114.323 -175.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.43 -17.45 19.19 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.623 1.582 . . . . 0.0 116.239 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -73.17 139.08 46.09 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.807 1.804 . . . . 0.0 114.088 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.79 152.09 33.29 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.807 1.643 . . . . 0.0 111.434 174.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -59.75 145.41 45.27 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 175.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -146.5 163.08 36.86 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.56 1.944 . . . . 0.0 110.592 -178.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.6 ptp -154.91 140.1 17.54 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -178.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.0 156.76 37.2 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.584 1.953 . . . . 0.0 115.221 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -22.03 66.27 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.7 p30 -79.0 -3.18 43.79 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.23 1.412 . . . . 0.0 114.593 174.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.24 19.16 47.11 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.675 1.131 . . . . 0.0 115.469 -178.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.5 m -94.59 129.75 41.3 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 118.834 1.317 . . . . 0.0 111.613 177.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.73 142.96 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.566 1.147 . . . . 0.0 110.299 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -149.18 -171.76 3.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.307 1.843 . . . . 0.0 108.81 174.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -128.49 143.9 51.05 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.449 1.5 . . . . 0.0 109.885 -177.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -134.15 134.56 42.3 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.21 1.404 . . . . 0.0 112.251 -176.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -96.13 115.0 26.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.476 0.71 . . . . 0.0 110.821 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.48 -22.99 60.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -85.33 -40.09 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.3 1.44 . . . . 0.0 111.053 -178.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.72 -6.85 15.74 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 60.23 13.73 4.11 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.991 2.116 . . . . 0.0 115.296 -175.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.85 153.08 43.78 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.248 1.019 . . . . 0.0 112.343 173.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.9 p -137.04 141.19 42.46 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.15 1.38 . . . . 0.0 111.496 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -153.39 144.02 22.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.158 0.983 . . . . 0.0 112.28 -172.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -83.01 -39.73 20.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 178.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -81.66 145.63 30.47 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.33 1.052 . . . . 0.0 112.199 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.67 113.31 5.77 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.978 1.311 . . . . 0.0 111.914 -176.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -60.19 129.34 29.66 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 123.706 2.937 . . . . 0.0 114.871 -170.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.6 m -86.64 148.84 25.29 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.313 1.045 . . . . 0.0 112.927 176.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.173 0 C-N-CA 125.135 1.35 . . . . 0.0 112.76 179.848 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.9 tttp . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 119.657 -0.211 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.9 mp -65.74 153.71 90.36 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 124.691 1.197 . . . . 0.0 111.579 177.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -66.59 162.08 38.56 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.415 2.744 . . . . 0.0 112.563 172.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.49 135.86 71.18 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 123.458 2.772 . . . . 0.0 114.049 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.79 -14.6 18.28 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.165 1.365 . . . . 0.0 116.198 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.0 m95 -85.22 144.54 28.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 118.706 1.253 . . . . 0.0 113.407 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.25 150.5 33.81 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.835 1.654 . . . . 0.0 111.23 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -65.82 145.04 56.44 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 176.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -144.75 165.83 26.96 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.233 2.213 . . . . 0.0 109.571 -175.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -154.79 135.86 13.86 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.291 -0.881 . . . . 0.0 112.511 -173.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -70.37 158.07 36.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.282 1.833 . . . . 0.0 115.629 172.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.48 -22.88 65.48 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -81.31 -3.32 52.22 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.415 1.486 . . . . 0.0 114.632 174.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.95 19.59 46.57 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.631 1.11 . . . . 0.0 115.614 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.3 m -94.6 128.43 41.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 118.969 1.384 . . . . 0.0 111.349 178.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.57 143.86 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.359 1.064 . . . . 0.0 110.213 -174.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -150.71 -172.97 4.33 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.968 1.707 . . . . 0.0 109.759 175.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -124.67 143.7 50.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.064 1.746 . . . . 0.0 110.007 -175.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -140.76 132.7 27.66 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.838 1.255 . . . . 0.0 111.568 -170.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -91.46 120.71 32.52 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.371 0.669 . . . . 0.0 110.685 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -77.13 -20.16 55.96 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -172.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.8 mp -86.06 -40.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.818 1.247 . . . . 0.0 111.741 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 p -108.95 -7.31 15.43 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -170.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.1 m-80 59.91 16.11 5.48 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.521 1.928 . . . . 0.0 114.814 -175.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.54 152.93 44.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.955 0.902 . . . . 0.0 111.837 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.7 p -136.72 148.24 47.2 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.621 1.169 . . . . 0.0 112.265 178.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.2 tp60 -156.25 142.42 18.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.357 1.463 . . . . 0.0 111.348 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.345 53.1 t80 -87.17 -49.76 7.07 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 118.815 2.894 . . . . 0.0 118.815 -171.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -88.08 151.01 23.04 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.031 0.933 . . . . 0.0 110.849 169.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 ttp180 -54.87 121.34 34.34 Favored Pre-proline 0 N--CA 1.48 1.034 0 CA-C-N 119.056 0.844 . . . . 0.0 111.53 -169.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -62.96 148.21 93.72 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.991 2.46 . . . . 0.0 112.313 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.7 p -67.56 141.47 56.82 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -170.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.755 1.645 . . . . 0.0 112.491 -174.43 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 119.837 -0.125 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 72.8 mt -120.81 162.45 34.8 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 126.392 1.877 . . . . 0.0 111.327 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.36 172.66 11.85 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 123.289 2.659 . . . . 0.0 112.998 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -52.19 124.15 14.22 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.629 2.886 . . . . 0.0 114.256 -176.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.66 -16.61 18.76 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.538 1.542 . . . . 0.0 116.148 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -74.85 139.3 43.1 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.767 1.784 . . . . 0.0 114.048 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.85 154.1 36.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.994 1.718 . . . . 0.0 111.108 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -61.97 145.14 53.85 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 175.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpt85 -142.82 163.05 33.85 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.281 2.232 . . . . 0.0 109.468 -175.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 50.8 ttp -154.78 136.1 14.07 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.348 -0.845 . . . . 0.0 112.853 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -70.49 157.72 37.35 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.161 1.784 . . . . 0.0 115.365 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.02 -22.42 65.7 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.6 -3.51 50.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.437 1.495 . . . . 0.0 114.631 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.75 43.71 Favored Glycine 0 CA--C 1.539 1.538 0 C-N-CA 124.6 1.095 . . . . 0.0 115.397 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.1 m -94.59 124.62 38.73 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.948 1.374 . . . . 0.0 111.482 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.4 t -94.75 142.81 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.346 1.059 . . . . 0.0 110.067 -173.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -149.47 -171.86 3.99 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.373 1.869 . . . . 0.0 109.639 176.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -123.59 142.42 51.05 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.668 1.587 . . . . 0.0 109.93 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -136.87 135.22 37.68 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.933 1.293 . . . . 0.0 112.652 -176.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -96.17 114.89 26.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.55 0.74 . . . . 0.0 110.757 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -73.82 -23.63 59.69 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.8 mt -84.8 -40.08 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.336 1.454 . . . . 0.0 111.07 -178.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.93 -7.47 15.42 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.18 1.918 . . . . 0.0 116.18 -171.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.27 15.37 5.29 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.802 2.041 . . . . 0.0 113.923 -175.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.67 155.64 40.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.052 -1.03 . . . . 0.0 112.08 172.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.1 p -141.18 150.03 42.23 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.641 1.176 . . . . 0.0 111.938 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -155.0 139.78 17.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.622 1.169 . . . . 0.0 111.3 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -78.86 -30.68 45.22 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 169.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -78.49 142.11 37.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.516 1.126 . . . . 0.0 111.858 171.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.04 120.09 54.58 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.113 0.965 . . . . 0.0 110.918 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.31 133.11 17.25 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.378 2.719 . . . . 0.0 113.378 -169.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t 58.97 175.8 0.07 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.53 1.932 . . . . 0.0 114.145 -174.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.265 0 C-N-CA 125.769 1.652 . . . . 0.0 112.843 -178.419 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 119.473 -0.299 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 80.7 mt -75.33 163.37 68.13 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 124.604 1.161 . . . . 0.0 111.518 169.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -69.14 167.76 22.7 Favored 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 123.346 2.697 . . . . 0.0 112.523 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -53.26 122.9 12.01 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.516 2.811 . . . . 0.0 113.937 -175.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.11 -15.14 45.86 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.474 1.512 . . . . 0.0 116.287 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -73.76 134.94 43.53 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 120.002 1.901 . . . . 0.0 114.109 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -145.51 162.04 38.33 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.85 2.06 . . . . 0.0 111.444 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -69.8 145.09 52.42 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.442 -0.786 . . . . 0.0 112.994 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -143.24 165.2 28.12 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.291 2.236 . . . . 0.0 109.835 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.2 ttm -154.63 134.25 12.78 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.362 -0.836 . . . . 0.0 112.512 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -71.26 158.58 36.14 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.334 1.853 . . . . 0.0 115.438 172.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.89 -22.44 65.56 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -81.0 -3.66 52.47 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.439 1.496 . . . . 0.0 114.625 174.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.04 22.24 39.19 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.538 1.066 . . . . 0.0 115.331 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.9 m -94.59 126.95 40.21 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.902 1.351 . . . . 0.0 111.116 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.7 t -94.69 142.67 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.195 0.998 . . . . 0.0 109.954 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -151.83 -174.29 4.81 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.947 1.699 . . . . 0.0 108.801 176.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -120.51 143.65 48.44 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.47 1.508 . . . . 0.0 110.637 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -142.66 136.11 28.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.598 1.159 . . . . 0.0 111.561 -172.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -94.77 117.0 29.42 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.252 0.621 . . . . 0.0 110.814 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -72.69 -22.98 60.82 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.3 mt -86.09 -40.08 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.708 1.603 . . . . 0.0 111.102 -177.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -112.12 -3.55 14.67 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.272 1.953 . . . . 0.0 116.272 -170.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.331 15.7 p30 53.69 17.36 1.21 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.89 2.476 . . . . 0.0 115.979 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.2 152.68 44.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.338 1.055 . . . . 0.0 111.931 170.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.6 p -141.02 148.65 40.62 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.8 1.24 . . . . 0.0 112.154 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -158.64 146.27 17.94 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.585 1.154 . . . . 0.0 111.804 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -84.36 -39.35 19.19 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -72.47 152.2 42.07 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.253 1.021 . . . . 0.0 111.939 170.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -66.12 127.3 93.12 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.68 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -59.4 165.69 8.87 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 123.925 3.083 . . . . 0.0 114.818 175.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.5 m -59.22 147.17 36.49 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.408 1.483 . . . . 0.0 114.829 -172.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.274 0 CA-C-O 117.661 -1.633 . . . . 0.0 112.752 -179.017 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.7 pttm . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.3 mp -107.39 159.08 31.5 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 126.201 1.8 . . . . 0.0 111.87 -176.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -65.09 165.61 21.24 Favored 'Trans proline' 0 CA--C 1.549 1.238 0 C-N-CA 123.965 3.11 . . . . 0.0 112.992 175.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -52.65 129.25 31.49 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 123.747 2.964 . . . . 0.0 114.826 -171.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.24 -22.44 3.73 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 125.705 1.622 . . . . 0.0 115.795 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -75.1 138.97 42.46 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.637 1.718 . . . . 0.0 113.771 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -147.37 165.52 29.94 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.685 1.994 . . . . 0.0 112.054 176.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -65.68 145.19 56.33 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -144.24 162.3 36.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.983 2.113 . . . . 0.0 110.082 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.3 ttp -154.73 137.24 15.07 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.439 -0.788 . . . . 0.0 112.811 -177.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -71.09 157.99 37.24 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.179 1.792 . . . . 0.0 115.461 172.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -23.09 65.88 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 p30 -81.02 -3.19 50.92 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.349 1.46 . . . . 0.0 114.537 174.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.43 19.99 46.87 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.61 1.1 . . . . 0.0 115.5 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.9 m -94.62 126.14 39.72 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.952 1.376 . . . . 0.0 111.344 177.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.0 t -94.65 142.12 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.255 1.022 . . . . 0.0 110.175 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -148.43 -168.73 3.17 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.55 1.94 . . . . 0.0 108.83 174.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -130.32 147.11 51.99 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.512 1.125 . . . . 0.0 109.591 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -142.48 134.59 27.38 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.56 1.544 . . . . 0.0 112.473 -169.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -92.96 116.17 28.8 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.331 0.653 . . . . 0.0 110.875 175.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -73.77 -22.01 59.99 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -176.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.6 mt -86.31 -40.19 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.668 1.587 . . . . 0.0 111.133 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 p -110.39 -6.26 15.01 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -171.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 60.52 14.82 5.12 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.783 2.033 . . . . 0.0 115.239 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.0 152.49 45.19 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.244 1.018 . . . . 0.0 111.984 172.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.1 p -140.38 143.73 35.85 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.925 1.29 . . . . 0.0 112.139 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -155.84 141.72 18.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.418 1.087 . . . . 0.0 111.145 -177.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.254 43.3 t80 -80.48 -37.01 32.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 177.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -70.65 145.36 50.68 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.48 1.112 . . . . 0.0 112.314 169.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.69 116.21 24.63 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.74 1.216 . . . . 0.0 111.165 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.23 148.01 38.42 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.7 2.933 . . . . 0.0 113.433 -169.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.4 p -154.31 162.47 41.15 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.822 1.249 . . . . 0.0 112.306 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.151 0 C-N-CA 125.167 1.365 . . . . 0.0 112.848 -178.964 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.3 tmmm? . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 45.9 mt 60.47 163.12 0.1 Allowed Pre-proline 0 CA--C 1.558 1.268 0 C-N-CA 127.385 2.274 . . . . 0.0 114.399 -171.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -68.46 170.5 14.81 Favored 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 123.493 2.795 . . . . 0.0 112.654 174.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -51.93 122.19 10.06 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.792 2.995 . . . . 0.0 114.447 -175.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.18 -17.62 17.12 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.678 1.609 . . . . 0.0 116.228 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -74.09 139.91 44.94 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.866 1.833 . . . . 0.0 114.028 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.04 155.72 38.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.055 1.742 . . . . 0.0 110.606 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.49 145.07 56.58 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.096 -1.002 . . . . 0.0 113.335 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -144.53 162.36 36.78 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.058 2.143 . . . . 0.0 109.648 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.8 ptp -154.82 140.11 17.64 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -72.77 159.12 34.3 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.302 1.841 . . . . 0.0 115.347 174.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.39 -22.77 66.4 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 178.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 p30 -80.27 -0.71 37.66 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.156 1.383 . . . . 0.0 114.491 173.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.12 18.76 55.17 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.664 1.126 . . . . 0.0 115.371 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.9 m -94.73 128.3 41.33 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.678 1.239 . . . . 0.0 110.974 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.3 t -94.7 143.2 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.644 1.178 . . . . 0.0 110.429 -176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -150.49 -173.57 4.5 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.27 1.828 . . . . 0.0 109.036 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -122.54 141.89 51.2 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.172 1.389 . . . . 0.0 110.547 -178.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -136.6 135.5 38.42 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.942 1.297 . . . . 0.0 112.232 -173.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -96.72 115.61 27.73 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.471 0.709 . . . . 0.0 110.739 176.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.36 -22.99 60.15 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -85.47 -40.09 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.001 -178.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.3 p -108.89 -7.14 15.51 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 60.33 13.78 4.23 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.932 2.093 . . . . 0.0 115.288 -175.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.83 153.93 42.66 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.227 1.011 . . . . 0.0 112.272 173.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.5 p -143.17 139.02 30.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.08 1.352 . . . . 0.0 111.876 179.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -154.87 154.11 32.19 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.539 0.735 . . . . 0.0 112.616 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -85.32 -39.42 17.69 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 117.743 2.497 . . . . 0.0 117.743 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -78.33 154.22 31.02 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.17 1.388 . . . . 0.0 111.312 174.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -64.96 125.73 89.71 Favored Pre-proline 0 CA--C 1.55 0.949 0 O-C-N 121.198 -0.938 . . . . 0.0 111.429 -176.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -58.6 157.68 26.5 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 124.143 3.228 . . . . 0.0 114.679 177.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 t -149.51 154.0 38.09 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.127 1.371 . . . . 0.0 111.401 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.129 0 C-N-CA 125.386 1.47 . . . . 0.0 112.729 -177.061 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.289 0 N-CA-C 116.26 1.264 . . . . 0.0 116.26 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -73.99 139.26 44.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.876 1.838 . . . . 0.0 113.909 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -151.37 156.76 41.38 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.609 1.564 . . . . 0.0 111.169 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.92 145.19 53.59 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 173.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 tpt85 -142.66 165.31 27.74 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.364 2.266 . . . . 0.0 109.613 -175.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.3 ttm -154.7 134.76 13.07 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.552 -0.718 . . . . 0.0 112.521 -175.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.1 158.55 35.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.32 1.848 . . . . 0.0 115.857 173.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.66 -22.92 65.71 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.7 p30 -80.97 -3.08 50.39 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.381 1.472 . . . . 0.0 114.566 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.96 19.93 48.87 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.745 1.164 . . . . 0.0 115.501 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.0 m -94.58 130.13 41.14 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 118.961 1.38 . . . . 0.0 111.231 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.76 143.16 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.408 1.083 . . . . 0.0 110.104 -176.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -151.25 -172.52 4.23 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.155 1.782 . . . . 0.0 108.834 175.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -123.47 141.85 51.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.323 1.449 . . . . 0.0 110.577 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -135.79 134.97 39.51 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.012 1.325 . . . . 0.0 112.566 -174.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -95.94 115.43 27.41 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.47 0.708 . . . . 0.0 110.671 176.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.46 -23.69 60.12 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.3 mt -84.61 -40.25 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.467 1.507 . . . . 0.0 111.086 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 p -109.21 -6.92 15.38 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -171.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.18 16.25 5.9 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 127.007 2.123 . . . . 0.0 113.932 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.21 154.36 41.07 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.053 -1.029 . . . . 0.0 112.059 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.2 p -143.76 138.53 28.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.889 1.276 . . . . 0.0 111.696 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -154.99 154.11 32.04 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 . . . . . 0 N--CA 1.473 0.712 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -177.231 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.298 0 N-CA-C 116.134 1.214 . . . . 0.0 116.134 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -75.22 137.5 41.29 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.75 1.775 . . . . 0.0 113.919 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -141.73 157.32 45.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.754 2.021 . . . . 0.0 111.106 174.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -68.85 145.11 54.0 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.399 -0.813 . . . . 0.0 112.783 169.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 -144.62 162.61 36.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.15 2.18 . . . . 0.0 109.59 -177.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.7 ptm -154.84 140.26 17.76 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -178.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -71.07 156.57 39.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.329 1.852 . . . . 0.0 114.986 172.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.86 -21.93 66.32 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -78.48 -3.21 42.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.098 1.359 . . . . 0.0 114.472 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.98 18.55 46.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.709 1.147 . . . . 0.0 115.416 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.64 127.37 40.55 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 118.914 1.357 . . . . 0.0 111.61 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.77 143.32 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.672 1.189 . . . . 0.0 110.371 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -150.28 -175.23 5.0 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.252 1.821 . . . . 0.0 109.172 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -120.54 143.88 48.35 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.13 1.372 . . . . 0.0 109.953 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -137.82 134.21 34.9 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.062 1.345 . . . . 0.0 112.14 -176.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -94.37 115.05 27.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.58 0.752 . . . . 0.0 110.78 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -73.64 -22.78 59.88 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -85.9 -40.17 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.427 1.491 . . . . 0.0 111.122 -178.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.6 p -109.32 -7.15 15.28 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 60.43 13.42 4.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.935 2.094 . . . . 0.0 115.306 -175.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.87 155.51 40.45 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.22 1.008 . . . . 0.0 112.272 172.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.8 p -138.35 150.06 46.21 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.044 1.338 . . . . 0.0 111.767 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -153.84 142.05 20.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.247 1.019 . . . . 0.0 110.987 -174.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 . . . . . 0 N--CA 1.474 0.729 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 172.678 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.298 0 N-CA-C 116.041 1.176 . . . . 0.0 116.041 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -76.08 136.73 39.88 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.465 1.632 . . . . 0.0 114.436 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -155.07 144.55 21.26 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.905 1.282 . . . . 0.0 111.579 169.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -58.11 145.16 37.72 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.265 1.426 . . . . 0.0 113.519 177.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.43 170.92 15.04 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 127.093 2.157 . . . . 0.0 110.788 -171.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.0 tpp -154.63 129.8 9.62 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.971 0.908 . . . . 0.0 112.153 -169.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -80.01 156.67 27.05 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 171.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.99 65.99 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -82.12 -0.29 44.06 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 125.363 1.465 . . . . 0.0 114.564 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.25 19.64 54.68 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.485 1.041 . . . . 0.0 115.274 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.7 m -94.72 132.14 39.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.747 1.219 . . . . 0.0 112.066 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -94.69 143.14 12.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 124.362 1.065 . . . . 0.0 109.228 -177.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -147.79 179.97 7.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.861 1.264 . . . . 0.0 110.378 173.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -119.48 139.29 52.32 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.537 1.935 . . . . 0.0 109.534 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -140.34 139.75 35.46 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.249 0.62 . . . . 0.0 112.296 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -100.64 115.52 30.39 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.273 1.029 . . . . 0.0 110.648 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -73.48 -22.22 60.21 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -86.55 -40.16 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 125.409 1.484 . . . . 0.0 111.134 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.8 p -109.77 -7.38 15.05 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 60.54 13.56 4.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.836 2.055 . . . . 0.0 115.391 -176.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.74 153.02 43.95 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.318 1.047 . . . . 0.0 112.157 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.7 p -142.88 149.97 39.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.753 1.221 . . . . 0.0 112.78 178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -149.18 151.66 34.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.803 1.641 . . . . 0.0 112.598 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 169.657 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 N-CA-C 115.809 1.083 . . . . 0.0 115.809 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -78.89 142.72 36.55 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.496 1.648 . . . . 0.0 113.947 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -152.23 152.09 31.78 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.534 1.934 . . . . 0.0 111.375 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -64.09 145.05 56.6 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.146 -0.971 . . . . 0.0 113.384 174.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.78 164.71 29.37 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.835 2.054 . . . . 0.0 109.968 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.2 ttp -154.74 137.06 14.9 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.528 -0.732 . . . . 0.0 112.64 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -71.54 158.09 36.84 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.186 1.794 . . . . 0.0 115.632 171.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.62 65.98 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -80.14 -3.4 48.72 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.362 1.465 . . . . 0.0 114.471 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.62 21.27 44.41 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.547 1.07 . . . . 0.0 115.382 -177.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.9 m -94.62 124.37 38.61 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.938 1.369 . . . . 0.0 111.249 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.7 t -94.69 142.78 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.274 1.029 . . . . 0.0 110.015 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -149.57 -174.35 4.66 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.117 1.767 . . . . 0.0 109.798 176.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -125.46 142.76 51.33 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.17 1.388 . . . . 0.0 109.871 -176.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.9 133.77 29.04 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.904 1.282 . . . . 0.0 112.8 -169.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -93.41 117.55 30.22 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.271 0.628 . . . . 0.0 110.842 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -74.72 -21.79 59.17 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.4 mt -85.4 -40.13 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.7 1.6 . . . . 0.0 110.987 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.9 p -110.71 -6.47 14.8 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -172.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 60.75 14.9 5.41 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.785 2.034 . . . . 0.0 115.235 -176.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.24 152.42 45.08 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.235 1.014 . . . . 0.0 112.099 172.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.2 p -141.19 147.28 38.1 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.721 1.209 . . . . 0.0 112.009 177.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -157.4 154.4 28.79 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.989 0.915 . . . . 0.0 112.465 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 118.441 2.756 . . . . 0.0 118.441 -177.998 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.372 0 N-CA-C 115.227 0.851 . . . . 0.0 115.227 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -81.04 141.72 34.08 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.958 1.379 . . . . 0.0 114.171 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.55 158.32 42.33 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.52 1.528 . . . . 0.0 111.312 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -60.81 145.16 50.88 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 171.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -145.06 162.68 36.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.024 2.129 . . . . 0.0 109.819 -177.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 56.4 ttp -154.82 135.92 13.89 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.417 -0.802 . . . . 0.0 112.649 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -72.37 159.83 33.36 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 115.867 1.802 . . . . 0.0 115.867 174.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -23.26 66.21 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -81.42 -0.5 41.79 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.213 1.405 . . . . 0.0 114.417 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.95 19.47 55.87 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.695 1.14 . . . . 0.0 115.245 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.0 m -94.65 125.59 39.4 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 118.777 1.288 . . . . 0.0 110.632 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.5 t -94.69 141.93 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.422 1.089 . . . . 0.0 109.951 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.8 p90 -150.91 -172.47 4.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.38 1.872 . . . . 0.0 108.417 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -125.78 144.87 50.45 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.57 1.148 . . . . 0.0 108.865 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -140.75 136.44 32.52 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.067 1.347 . . . . 0.0 112.26 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -93.87 115.33 27.71 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.758 0.823 . . . . 0.0 110.487 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -73.51 -21.99 60.24 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.1 mt -86.2 -40.04 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.745 1.618 . . . . 0.0 111.074 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -111.28 -7.13 14.44 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -171.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 60.84 13.75 4.68 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.746 2.018 . . . . 0.0 115.193 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.99 155.54 40.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.149 0.98 . . . . 0.0 112.057 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.7 p -141.93 148.97 39.53 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.699 1.2 . . . . 0.0 112.237 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -150.8 139.8 21.02 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.212 1.405 . . . . 0.0 112.915 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.51 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.323 0 N-CA-C 116.119 1.207 . . . . 0.0 116.119 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -74.43 137.8 42.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.645 1.722 . . . . 0.0 114.247 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -153.49 153.5 32.56 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.39 1.876 . . . . 0.0 111.104 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -66.42 145.04 56.13 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 175.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -143.1 162.99 34.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.187 2.195 . . . . 0.0 109.517 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.5 ttp -154.72 136.39 14.37 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 112.668 -175.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -71.7 157.91 37.09 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.102 1.761 . . . . 0.0 115.628 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.18 -22.34 65.82 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -80.15 -3.19 47.9 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.323 1.449 . . . . 0.0 114.427 173.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.34 21.78 43.46 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 124.595 1.093 . . . . 0.0 115.322 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -94.64 123.32 38.01 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 118.798 1.299 . . . . 0.0 111.3 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.79 142.56 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.406 1.083 . . . . 0.0 109.683 -175.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -151.05 -175.74 5.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.073 1.749 . . . . 0.0 109.545 177.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -119.65 141.57 49.22 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.654 1.582 . . . . 0.0 110.949 -177.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -139.06 135.81 34.59 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.742 1.217 . . . . 0.0 112.223 -173.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -96.59 115.25 27.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.554 0.742 . . . . 0.0 110.653 176.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.04 -22.61 60.59 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.9 mt -85.76 -40.07 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 125.454 1.502 . . . . 0.0 110.986 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.0 p -109.48 -7.32 15.19 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.175 1.916 . . . . 0.0 116.175 -171.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.52 13.49 4.21 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.936 2.094 . . . . 0.0 115.298 -175.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.21 153.33 43.85 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.187 0.995 . . . . 0.0 112.258 173.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 86.9 p -138.72 148.87 44.45 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.893 1.277 . . . . 0.0 112.052 176.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -157.61 145.91 19.15 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.674 1.19 . . . . 0.0 112.004 -175.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 N--CA 1.472 0.627 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 175.889 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.325 0 N-CA-C 116.122 1.209 . . . . 0.0 116.122 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -73.21 133.24 43.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.875 1.838 . . . . 0.0 113.836 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -144.23 161.69 38.25 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.511 1.924 . . . . 0.0 111.484 173.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -65.49 145.2 56.42 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -143.78 164.09 31.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.216 2.206 . . . . 0.0 109.585 -175.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 77.1 mtm -154.45 136.9 15.0 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -79.6 156.42 27.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.296 1.838 . . . . 0.0 115.441 172.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.34 66.44 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.2 p30 -79.91 -2.95 45.97 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.337 1.455 . . . . 0.0 114.58 174.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.29 20.9 43.4 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.548 1.071 . . . . 0.0 115.444 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.7 m -94.63 134.58 37.05 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.788 1.294 . . . . 0.0 111.63 177.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.7 t -94.71 141.55 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.996 1.318 . . . . 0.0 110.961 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.37 -172.11 4.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.494 1.517 . . . . 0.0 108.718 172.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.38 142.29 51.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.662 1.585 . . . . 0.0 110.392 -176.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.37 134.94 31.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.604 1.161 . . . . 0.0 112.525 -172.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -95.47 113.66 25.35 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.784 0.833 . . . . 0.0 110.614 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -72.53 -22.06 61.09 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.5 -40.11 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.482 1.513 . . . . 0.0 111.062 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -109.51 -6.9 15.25 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 116.177 1.918 . . . . 0.0 116.177 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.62 13.58 4.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.886 2.074 . . . . 0.0 115.276 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.57 153.63 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.158 0.983 . . . . 0.0 112.256 172.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.8 p -140.44 147.0 39.01 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.009 1.324 . . . . 0.0 112.026 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -154.13 143.61 21.52 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.839 0.856 . . . . 0.0 111.915 -175.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 175.975 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.329 0 N-CA-C 116.161 1.225 . . . . 0.0 116.161 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -73.36 139.0 45.69 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.88 1.84 . . . . 0.0 114.209 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.63 152.71 33.2 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.942 1.697 . . . . 0.0 111.42 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -63.72 145.12 56.35 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -146.08 162.18 38.49 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.577 1.951 . . . . 0.0 109.655 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.4 ptm -154.87 140.25 17.72 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.33 156.02 40.0 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.1 1.76 . . . . 0.0 114.885 172.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.06 -21.48 66.19 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -78.29 -3.47 43.08 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.187 1.395 . . . . 0.0 114.435 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.65 20.2 41.5 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 124.601 1.096 . . . . 0.0 115.199 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.2 m -94.62 125.08 39.04 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.867 1.333 . . . . 0.0 111.592 177.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.1 t -94.74 142.49 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.539 1.136 . . . . 0.0 110.348 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -149.46 -172.59 4.17 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.372 1.869 . . . . 0.0 109.359 175.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -127.54 144.16 51.1 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.476 1.511 . . . . 0.0 110.321 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -135.98 137.09 40.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.904 1.281 . . . . 0.0 111.247 -176.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -97.42 115.76 28.36 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.465 0.706 . . . . 0.0 110.85 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -72.89 -24.09 60.81 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.55 -40.23 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.479 1.512 . . . . 0.0 111.089 -178.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.8 p -110.15 -3.53 16.3 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -170.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.319 16.3 p30 53.84 15.04 0.74 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 128.271 2.628 . . . . 0.0 116.071 -174.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.27 156.22 39.11 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.62 1.168 . . . . 0.0 112.308 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.6 p -136.76 149.64 47.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.797 1.239 . . . . 0.0 111.763 173.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -155.8 145.38 21.07 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.539 1.136 . . . . 0.0 111.584 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 175.669 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.371 0 N-CA-C 115.564 0.985 . . . . 0.0 115.564 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -79.81 146.12 32.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.223 1.511 . . . . 0.0 114.107 177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -145.6 157.99 43.9 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.158 2.183 . . . . 0.0 111.581 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -75.75 145.12 41.05 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.774 -0.579 . . . . 0.0 111.347 169.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -146.9 164.29 33.37 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.525 1.53 . . . . 0.0 110.103 -177.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.1 ttm -154.66 135.59 13.76 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.383 -0.823 . . . . 0.0 112.552 -171.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -72.25 158.13 36.42 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.39 1.876 . . . . 0.0 115.6 172.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.21 65.38 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.87 -3.33 50.91 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.424 1.49 . . . . 0.0 114.55 174.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.8 20.92 45.09 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.658 1.123 . . . . 0.0 115.443 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.57 128.55 41.27 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 118.916 1.358 . . . . 0.0 111.289 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.3 t -94.71 142.86 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.185 0.994 . . . . 0.0 110.039 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -148.66 -175.29 4.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.336 1.854 . . . . 0.0 109.274 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -125.2 143.88 50.73 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.179 1.392 . . . . 0.0 110.277 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -141.49 136.93 31.72 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.466 1.107 . . . . 0.0 110.494 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -96.24 119.1 34.13 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.536 0.735 . . . . 0.0 111.081 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -73.75 -23.52 59.76 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.0 mt -84.24 -40.23 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.852 1.661 . . . . 0.0 111.016 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -112.7 -3.01 14.34 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -170.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.327 15.8 p30 53.87 16.84 1.15 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.933 2.493 . . . . 0.0 116.046 -174.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.51 154.75 39.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.417 1.087 . . . . 0.0 111.906 171.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.2 p -144.49 146.57 32.49 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.361 1.064 . . . . 0.0 112.087 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -157.71 156.13 31.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.102 0.961 . . . . 0.0 112.3 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 118.499 2.778 . . . . 0.0 118.499 -177.939 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.296 0 N-CA-C 116.154 1.222 . . . . 0.0 116.154 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -73.56 140.12 46.07 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.918 1.859 . . . . 0.0 114.189 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -149.46 154.79 39.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.674 1.59 . . . . 0.0 110.693 174.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -64.13 145.1 56.52 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 173.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -144.18 163.64 33.02 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.16 2.184 . . . . 0.0 109.651 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 54.1 ttp -154.71 136.33 14.33 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.205 -0.934 . . . . 0.0 112.696 -176.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -72.1 158.04 36.66 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.194 1.798 . . . . 0.0 115.792 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.07 -22.94 66.18 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.4 p30 -80.09 -2.94 46.61 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.302 1.441 . . . . 0.0 114.43 173.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.52 20.61 47.42 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.745 1.164 . . . . 0.0 115.4 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 54.4 m -94.63 124.78 38.87 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 118.941 1.371 . . . . 0.0 111.043 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -94.64 141.91 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.391 1.076 . . . . 0.0 109.395 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.76 -170.32 3.62 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.201 1.8 . . . . 0.0 108.403 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -126.02 143.97 50.9 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.445 1.498 . . . . 0.0 110.163 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -135.69 134.88 39.61 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.163 1.385 . . . . 0.0 112.098 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -95.61 115.22 27.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.436 0.694 . . . . 0.0 110.69 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -73.41 -23.21 60.11 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -85.1 -40.1 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.371 1.468 . . . . 0.0 111.101 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.0 p -108.74 -7.36 15.59 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 60.26 13.64 4.08 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.005 2.122 . . . . 0.0 115.357 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.71 154.53 41.29 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.364 1.065 . . . . 0.0 112.404 173.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -132.95 148.33 52.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.166 1.387 . . . . 0.0 111.689 173.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -156.75 143.19 18.3 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.588 1.155 . . . . 0.0 112.0 -170.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.267 63.4 m-85 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 118.604 2.816 . . . . 0.0 118.604 -175.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.258 0 N-CA-C 116.262 1.265 . . . . 0.0 116.262 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -73.83 140.31 45.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.94 1.87 . . . . 0.0 114.175 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -152.27 150.46 29.8 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.403 1.881 . . . . 0.0 111.238 178.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -66.95 145.05 55.83 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.69 167.09 22.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 127.262 2.225 . . . . 0.0 110.05 -175.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.3 ttm -154.72 134.57 12.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.617 -0.677 . . . . 0.0 112.574 -174.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -71.29 158.55 36.17 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.47 1.908 . . . . 0.0 115.994 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.47 -23.04 65.6 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.3 p30 -81.3 -2.73 50.16 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.278 1.431 . . . . 0.0 114.515 174.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.74 19.75 50.27 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.731 1.158 . . . . 0.0 115.511 -178.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 59.9 m -94.7 131.07 40.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 118.995 1.397 . . . . 0.0 111.253 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.4 t -94.65 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.337 1.055 . . . . 0.0 109.986 -176.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.3 -176.17 5.27 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.949 1.7 . . . . 0.0 109.536 174.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.53 144.69 48.57 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.703 1.601 . . . . 0.0 110.237 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -139.36 135.72 34.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.898 1.279 . . . . 0.0 111.968 -175.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -97.02 116.77 29.81 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.283 0.633 . . . . 0.0 110.799 175.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -74.01 -22.95 59.39 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -176.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.9 mt -85.06 -40.17 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.502 1.521 . . . . 0.0 110.989 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.0 p -110.18 -6.12 15.15 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -171.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 60.17 14.76 4.74 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.796 2.038 . . . . 0.0 115.267 -175.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.56 152.27 45.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.211 1.004 . . . . 0.0 112.183 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.0 p -140.24 142.26 35.82 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.981 1.312 . . . . 0.0 111.914 177.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -155.08 146.39 22.91 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.181 0.993 . . . . 0.0 111.915 -174.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 176.772 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.255 0 N-CA-C 115.653 1.021 . . . . 0.0 115.653 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -76.9 140.96 40.71 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 119.461 1.631 . . . . 0.0 113.785 178.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -153.48 154.38 34.27 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.945 1.698 . . . . 0.0 111.438 176.114 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -57.01 145.36 30.69 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -146.93 164.34 33.25 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.685 1.994 . . . . 0.0 110.5 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 53.1 ttp -154.79 135.84 13.86 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.61 -0.681 . . . . 0.0 112.615 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -71.05 158.15 36.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.192 1.797 . . . . 0.0 115.65 172.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.98 65.99 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.2 p30 -80.36 -3.08 48.18 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.349 1.46 . . . . 0.0 114.455 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.01 20.07 48.09 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.737 1.16 . . . . 0.0 115.416 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 56.1 m -94.68 126.11 39.77 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 119.026 1.413 . . . . 0.0 111.16 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.5 t -94.68 142.26 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.279 1.031 . . . . 0.0 109.85 -174.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -150.34 -173.05 4.33 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.192 1.797 . . . . 0.0 109.032 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -128.16 141.73 51.39 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.38 1.472 . . . . 0.0 109.034 -175.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -137.98 134.16 34.55 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.831 1.253 . . . . 0.0 112.126 -170.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -92.97 114.73 27.37 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 110.678 177.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.03 -22.67 60.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.7 mt -85.13 -40.18 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 111.056 -177.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 p -111.76 -6.81 14.27 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -171.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 60.76 14.13 4.87 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.766 2.026 . . . . 0.0 115.193 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.95 155.57 39.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.088 0.955 . . . . 0.0 112.217 172.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 70.8 p -141.91 145.32 34.43 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.868 1.267 . . . . 0.0 111.993 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -152.14 142.72 22.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.297 1.039 . . . . 0.0 111.703 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 117.167 2.284 . . . . 0.0 117.167 176.485 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.395 0 N-CA-C 116.15 1.22 . . . . 0.0 116.15 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -73.66 135.79 43.78 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.943 1.872 . . . . 0.0 113.832 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -145.66 163.75 33.89 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.904 1.682 . . . . 0.0 112.243 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.43 145.12 56.59 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 172.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -143.5 161.67 37.83 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.213 2.205 . . . . 0.0 109.769 -176.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.7 ttt -154.77 131.37 10.6 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -171.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -77.69 155.09 31.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.589 1.955 . . . . 0.0 115.514 175.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -22.36 66.82 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -79.94 -0.79 36.58 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.61 13.14 56.02 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 124.701 1.144 . . . . 0.0 115.418 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 30.9 m -94.68 127.56 40.75 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.863 1.331 . . . . 0.0 112.343 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.79 142.98 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.475 1.11 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -149.62 -169.02 3.27 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.328 1.851 . . . . 0.0 108.83 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -127.46 145.37 50.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.573 1.549 . . . . 0.0 110.429 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -141.2 134.63 29.79 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.107 1.363 . . . . 0.0 112.241 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -94.73 115.78 27.94 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.726 176.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.71 -22.42 59.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.6 mt -85.68 -40.13 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.508 1.523 . . . . 0.0 111.08 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -110.49 -6.02 15.01 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -171.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.35 14.66 4.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.819 2.047 . . . . 0.0 115.302 -176.028 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.75 152.51 45.23 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.146 0.979 . . . . 0.0 112.161 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 56.6 p -139.8 144.24 37.26 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.99 1.316 . . . . 0.0 111.986 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -156.79 143.76 18.66 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.455 1.102 . . . . 0.0 111.049 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.253 43.3 t80 . . . . . 0 N--CA 1.47 0.543 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 177.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.344 0 N-CA-C 116.075 1.19 . . . . 0.0 116.075 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -73.72 138.23 44.51 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.72 1.76 . . . . 0.0 113.943 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.72 154.7 36.82 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.157 1.783 . . . . 0.0 111.205 175.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -62.55 145.02 55.39 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -144.11 163.54 33.28 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.169 2.188 . . . . 0.0 109.74 -176.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.1 ttm -154.71 135.06 13.28 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.412 -0.805 . . . . 0.0 112.521 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -71.25 158.14 36.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.271 1.828 . . . . 0.0 115.81 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -22.57 65.42 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.83 -3.32 50.72 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.396 1.478 . . . . 0.0 114.505 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.83 21.03 44.5 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 124.721 1.153 . . . . 0.0 115.448 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.2 m -94.61 127.03 40.29 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.999 1.4 . . . . 0.0 111.237 178.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.6 t -94.65 142.96 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.431 1.092 . . . . 0.0 110.359 -176.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -151.39 -175.61 5.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.114 1.765 . . . . 0.0 109.199 175.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -118.93 142.67 47.56 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.955 1.302 . . . . 0.0 110.351 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -135.94 134.59 38.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.243 1.417 . . . . 0.0 112.706 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -96.31 114.62 26.32 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.432 0.693 . . . . 0.0 110.77 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -73.41 -22.84 60.13 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.6 mt -85.14 -40.16 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.357 1.463 . . . . 0.0 111.048 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 p -108.62 -7.04 15.76 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -172.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.41 13.29 3.98 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.922 2.089 . . . . 0.0 115.313 -175.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.66 152.63 45.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.055 0.942 . . . . 0.0 112.116 173.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.1 p -138.8 145.46 40.14 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.6 1.16 . . . . 0.0 111.482 174.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -157.05 143.81 18.4 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.092 0.957 . . . . 0.0 112.286 -174.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 176.321 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 N-CA-C 116.239 1.256 . . . . 0.0 116.239 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -73.17 139.08 46.09 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.807 1.804 . . . . 0.0 114.088 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.79 152.09 33.29 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.807 1.643 . . . . 0.0 111.434 174.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -59.75 145.41 45.27 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 175.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -146.5 163.08 36.86 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.56 1.944 . . . . 0.0 110.592 -178.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.6 ptp -154.91 140.1 17.54 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -178.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.0 156.76 37.2 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.584 1.953 . . . . 0.0 115.221 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -22.03 66.27 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.7 p30 -79.0 -3.18 43.79 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.23 1.412 . . . . 0.0 114.593 174.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.24 19.16 47.11 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.675 1.131 . . . . 0.0 115.469 -178.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.5 m -94.59 129.75 41.3 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 118.834 1.317 . . . . 0.0 111.613 177.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.73 142.96 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.566 1.147 . . . . 0.0 110.299 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -149.18 -171.76 3.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.307 1.843 . . . . 0.0 108.81 174.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -128.49 143.9 51.05 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.449 1.5 . . . . 0.0 109.885 -177.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -134.15 134.56 42.3 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.21 1.404 . . . . 0.0 112.251 -176.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -96.13 115.0 26.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.476 0.71 . . . . 0.0 110.821 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.48 -22.99 60.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -85.33 -40.09 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.3 1.44 . . . . 0.0 111.053 -178.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.72 -6.85 15.74 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 60.23 13.73 4.11 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.991 2.116 . . . . 0.0 115.296 -175.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.85 153.08 43.78 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.248 1.019 . . . . 0.0 112.343 173.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.9 p -137.04 141.19 42.46 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.15 1.38 . . . . 0.0 111.496 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -153.39 144.02 22.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.158 0.983 . . . . 0.0 112.28 -172.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 178.468 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.392 0 N-CA-C 116.198 1.239 . . . . 0.0 116.198 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.0 m95 -85.22 144.54 28.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 118.706 1.253 . . . . 0.0 113.407 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.25 150.5 33.81 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.835 1.654 . . . . 0.0 111.23 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -65.82 145.04 56.44 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 176.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -144.75 165.83 26.96 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.233 2.213 . . . . 0.0 109.571 -175.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -154.79 135.86 13.86 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.291 -0.881 . . . . 0.0 112.511 -173.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -70.37 158.07 36.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.282 1.833 . . . . 0.0 115.629 172.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.48 -22.88 65.48 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -81.31 -3.32 52.22 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.415 1.486 . . . . 0.0 114.632 174.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.95 19.59 46.57 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.631 1.11 . . . . 0.0 115.614 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.3 m -94.6 128.43 41.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 118.969 1.384 . . . . 0.0 111.349 178.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.57 143.86 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.359 1.064 . . . . 0.0 110.213 -174.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -150.71 -172.97 4.33 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.968 1.707 . . . . 0.0 109.759 175.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -124.67 143.7 50.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.064 1.746 . . . . 0.0 110.007 -175.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -140.76 132.7 27.66 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.838 1.255 . . . . 0.0 111.568 -170.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -91.46 120.71 32.52 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.371 0.669 . . . . 0.0 110.685 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -77.13 -20.16 55.96 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -172.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.8 mp -86.06 -40.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.818 1.247 . . . . 0.0 111.741 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 p -108.95 -7.31 15.43 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -170.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.1 m-80 59.91 16.11 5.48 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.521 1.928 . . . . 0.0 114.814 -175.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.54 152.93 44.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.955 0.902 . . . . 0.0 111.837 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.7 p -136.72 148.24 47.2 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.621 1.169 . . . . 0.0 112.265 178.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.2 tp60 -156.25 142.42 18.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.357 1.463 . . . . 0.0 111.348 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.345 53.1 t80 . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 118.815 2.894 . . . . 0.0 118.815 -171.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.372 0 N-CA-C 116.148 1.219 . . . . 0.0 116.148 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -74.85 139.3 43.1 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.767 1.784 . . . . 0.0 114.048 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.85 154.1 36.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.994 1.718 . . . . 0.0 111.108 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -61.97 145.14 53.85 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 175.331 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpt85 -142.82 163.05 33.85 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.281 2.232 . . . . 0.0 109.468 -175.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 50.8 ttp -154.78 136.1 14.07 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.348 -0.845 . . . . 0.0 112.853 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -70.49 157.72 37.35 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.161 1.784 . . . . 0.0 115.365 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.02 -22.42 65.7 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.6 -3.51 50.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.437 1.495 . . . . 0.0 114.631 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.75 43.71 Favored Glycine 0 CA--C 1.539 1.538 0 C-N-CA 124.6 1.095 . . . . 0.0 115.397 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.1 m -94.59 124.62 38.73 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.948 1.374 . . . . 0.0 111.482 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.4 t -94.75 142.81 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.346 1.059 . . . . 0.0 110.067 -173.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -149.47 -171.86 3.99 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.373 1.869 . . . . 0.0 109.639 176.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -123.59 142.42 51.05 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.668 1.587 . . . . 0.0 109.93 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -136.87 135.22 37.68 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.933 1.293 . . . . 0.0 112.652 -176.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -96.17 114.89 26.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.55 0.74 . . . . 0.0 110.757 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -73.82 -23.63 59.69 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.8 mt -84.8 -40.08 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.336 1.454 . . . . 0.0 111.07 -178.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.93 -7.47 15.42 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.18 1.918 . . . . 0.0 116.18 -171.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.27 15.37 5.29 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.802 2.041 . . . . 0.0 113.923 -175.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.67 155.64 40.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.052 -1.03 . . . . 0.0 112.08 172.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.1 p -141.18 150.03 42.23 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.641 1.176 . . . . 0.0 111.938 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -155.0 139.78 17.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.622 1.169 . . . . 0.0 111.3 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 48.8 t80 . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 169.738 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.34 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -73.76 134.94 43.53 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 120.002 1.901 . . . . 0.0 114.109 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -145.51 162.04 38.33 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.85 2.06 . . . . 0.0 111.444 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -69.8 145.09 52.42 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.442 -0.786 . . . . 0.0 112.994 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -143.24 165.2 28.12 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.291 2.236 . . . . 0.0 109.835 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.2 ttm -154.63 134.25 12.78 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.362 -0.836 . . . . 0.0 112.512 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -71.26 158.58 36.14 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.334 1.853 . . . . 0.0 115.438 172.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.89 -22.44 65.56 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -81.0 -3.66 52.47 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.439 1.496 . . . . 0.0 114.625 174.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.04 22.24 39.19 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.538 1.066 . . . . 0.0 115.331 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.9 m -94.59 126.95 40.21 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.902 1.351 . . . . 0.0 111.116 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.7 t -94.69 142.67 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.195 0.998 . . . . 0.0 109.954 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -151.83 -174.29 4.81 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.947 1.699 . . . . 0.0 108.801 176.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -120.51 143.65 48.44 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.47 1.508 . . . . 0.0 110.637 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -142.66 136.11 28.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.598 1.159 . . . . 0.0 111.561 -172.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -94.77 117.0 29.42 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.252 0.621 . . . . 0.0 110.814 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -72.69 -22.98 60.82 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.3 mt -86.09 -40.08 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.708 1.603 . . . . 0.0 111.102 -177.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -112.12 -3.55 14.67 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.272 1.953 . . . . 0.0 116.272 -170.341 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.331 15.7 p30 53.69 17.36 1.21 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.89 2.476 . . . . 0.0 115.979 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.2 152.68 44.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.338 1.055 . . . . 0.0 111.931 170.327 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.6 p -141.02 148.65 40.62 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.8 1.24 . . . . 0.0 112.154 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -158.64 146.27 17.94 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.585 1.154 . . . . 0.0 111.804 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 177.386 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.294 0 N-CA-C 115.795 1.078 . . . . 0.0 115.795 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -75.1 138.97 42.46 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.637 1.718 . . . . 0.0 113.771 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -147.37 165.52 29.94 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.685 1.994 . . . . 0.0 112.054 176.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -65.68 145.19 56.33 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -144.24 162.3 36.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.983 2.113 . . . . 0.0 110.082 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.3 ttp -154.73 137.24 15.07 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.439 -0.788 . . . . 0.0 112.811 -177.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -71.09 157.99 37.24 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.179 1.792 . . . . 0.0 115.461 172.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -23.09 65.88 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 p30 -81.02 -3.19 50.92 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.349 1.46 . . . . 0.0 114.537 174.231 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.43 19.99 46.87 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.61 1.1 . . . . 0.0 115.5 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.9 m -94.62 126.14 39.72 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.952 1.376 . . . . 0.0 111.344 177.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.0 t -94.65 142.12 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.255 1.022 . . . . 0.0 110.175 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -148.43 -168.73 3.17 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.55 1.94 . . . . 0.0 108.83 174.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -130.32 147.11 51.99 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.512 1.125 . . . . 0.0 109.591 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -142.48 134.59 27.38 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.56 1.544 . . . . 0.0 112.473 -169.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -92.96 116.17 28.8 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.331 0.653 . . . . 0.0 110.875 175.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -73.77 -22.01 59.99 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -176.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.6 mt -86.31 -40.19 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.668 1.587 . . . . 0.0 111.133 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 p -110.39 -6.26 15.01 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -171.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 60.52 14.82 5.12 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.783 2.033 . . . . 0.0 115.239 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.0 152.49 45.19 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.244 1.018 . . . . 0.0 111.984 172.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.1 p -140.38 143.73 35.85 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.925 1.29 . . . . 0.0 112.139 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -155.84 141.72 18.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.418 1.087 . . . . 0.0 111.145 -177.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.254 43.3 t80 . . . . . 0 CA--C 1.538 0.502 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 177.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.305 0 N-CA-C 116.228 1.251 . . . . 0.0 116.228 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -74.09 139.91 44.94 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.866 1.833 . . . . 0.0 114.028 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.04 155.72 38.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.055 1.742 . . . . 0.0 110.606 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.49 145.07 56.58 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.096 -1.002 . . . . 0.0 113.335 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -144.53 162.36 36.78 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.058 2.143 . . . . 0.0 109.648 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.8 ptp -154.82 140.11 17.64 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -72.77 159.12 34.3 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.302 1.841 . . . . 0.0 115.347 174.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.39 -22.77 66.4 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 178.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 p30 -80.27 -0.71 37.66 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.156 1.383 . . . . 0.0 114.491 173.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.12 18.76 55.17 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.664 1.126 . . . . 0.0 115.371 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.9 m -94.73 128.3 41.33 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.678 1.239 . . . . 0.0 110.974 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.3 t -94.7 143.2 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.644 1.178 . . . . 0.0 110.429 -176.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -150.49 -173.57 4.5 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.27 1.828 . . . . 0.0 109.036 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -122.54 141.89 51.2 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.172 1.389 . . . . 0.0 110.547 -178.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -136.6 135.5 38.42 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.942 1.297 . . . . 0.0 112.232 -173.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -96.72 115.61 27.73 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.471 0.709 . . . . 0.0 110.739 176.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.36 -22.99 60.15 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -85.47 -40.09 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.001 -178.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.3 p -108.89 -7.14 15.51 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 60.33 13.78 4.23 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.932 2.093 . . . . 0.0 115.288 -175.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.83 153.93 42.66 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.227 1.011 . . . . 0.0 112.272 173.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.5 p -143.17 139.02 30.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.08 1.352 . . . . 0.0 111.876 179.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -154.87 154.11 32.19 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.539 0.735 . . . . 0.0 112.616 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 117.743 2.497 . . . . 0.0 117.743 -178.238 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 119.307 -0.378 . . . . 0.0 111.064 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 19.4 mt -148.15 164.26 22.96 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 126.797 2.039 . . . . 0.0 110.626 -174.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -66.08 168.28 16.05 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.66 2.907 . . . . 0.0 112.851 174.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.32 123.23 12.24 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.817 3.011 . . . . 0.0 114.51 -174.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.64 -17.26 21.32 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.666 1.603 . . . . 0.0 116.26 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -73.99 139.26 44.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.876 1.838 . . . . 0.0 113.909 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -151.37 156.76 41.38 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.609 1.564 . . . . 0.0 111.169 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.92 145.19 53.59 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 173.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 tpt85 -142.66 165.31 27.74 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.364 2.266 . . . . 0.0 109.613 -175.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.3 ttm -154.7 134.76 13.07 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.552 -0.718 . . . . 0.0 112.521 -175.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.1 158.55 35.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.32 1.848 . . . . 0.0 115.857 173.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.66 -22.92 65.71 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.7 p30 -80.97 -3.08 50.39 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.381 1.472 . . . . 0.0 114.566 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.96 19.93 48.87 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.745 1.164 . . . . 0.0 115.501 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.0 m -94.58 130.13 41.14 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 118.961 1.38 . . . . 0.0 111.231 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.76 143.16 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.408 1.083 . . . . 0.0 110.104 -176.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -151.25 -172.52 4.23 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.155 1.782 . . . . 0.0 108.834 175.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -123.47 141.85 51.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.323 1.449 . . . . 0.0 110.577 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -135.79 134.97 39.51 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.012 1.325 . . . . 0.0 112.566 -174.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -95.94 115.43 27.41 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.47 0.708 . . . . 0.0 110.671 176.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.46 -23.69 60.12 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.3 mt -84.61 -40.25 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.467 1.507 . . . . 0.0 111.086 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 p -109.21 -6.92 15.38 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -171.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.18 16.25 5.9 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 127.007 2.123 . . . . 0.0 113.932 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.21 154.36 41.07 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.053 -1.029 . . . . 0.0 112.059 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.2 p -143.76 138.53 28.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.889 1.276 . . . . 0.0 111.696 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -154.99 154.11 32.04 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -85.63 -37.03 19.95 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -177.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -82.75 149.35 27.31 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.723 1.209 . . . . 0.0 110.898 174.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -60.29 125.66 82.23 Favored Pre-proline 0 CA--C 1.548 0.902 0 O-C-N 121.2 -0.938 . . . . 0.0 111.813 -176.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -57.92 153.78 42.38 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 124.27 3.313 . . . . 0.0 113.307 176.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.2 m -146.93 153.97 40.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.036 1.334 . . . . 0.0 112.073 -175.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.222 0 C-N-CA 125.141 1.353 . . . . 0.0 112.946 -178.348 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 111.47 0.174 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.2 mt -135.22 163.03 53.92 Favored Pre-proline 0 CA--C 1.551 1.0 0 C-N-CA 126.508 1.923 . . . . 0.0 110.891 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -67.14 170.47 13.11 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.25 2.633 . . . . 0.0 113.015 177.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -52.6 123.5 13.02 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.595 2.863 . . . . 0.0 114.37 -175.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.19 -15.71 21.04 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 125.632 1.587 . . . . 0.0 116.134 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -75.22 137.5 41.29 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.75 1.775 . . . . 0.0 113.919 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -141.73 157.32 45.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.754 2.021 . . . . 0.0 111.106 174.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -68.85 145.11 54.0 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.399 -0.813 . . . . 0.0 112.783 169.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 -144.62 162.61 36.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.15 2.18 . . . . 0.0 109.59 -177.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.7 ptm -154.84 140.26 17.76 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -178.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -71.07 156.57 39.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.329 1.852 . . . . 0.0 114.986 172.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.86 -21.93 66.32 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -78.48 -3.21 42.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.098 1.359 . . . . 0.0 114.472 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.98 18.55 46.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.709 1.147 . . . . 0.0 115.416 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.64 127.37 40.55 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 118.914 1.357 . . . . 0.0 111.61 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.77 143.32 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.672 1.189 . . . . 0.0 110.371 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -150.28 -175.23 5.0 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.252 1.821 . . . . 0.0 109.172 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -120.54 143.88 48.35 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.13 1.372 . . . . 0.0 109.953 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -137.82 134.21 34.9 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.062 1.345 . . . . 0.0 112.14 -176.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -94.37 115.05 27.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.58 0.752 . . . . 0.0 110.78 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -73.64 -22.78 59.88 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -85.9 -40.17 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.427 1.491 . . . . 0.0 111.122 -178.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.6 p -109.32 -7.15 15.28 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 60.43 13.42 4.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.935 2.094 . . . . 0.0 115.306 -175.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.87 155.51 40.45 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.22 1.008 . . . . 0.0 112.272 172.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.8 p -138.35 150.06 46.21 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.044 1.338 . . . . 0.0 111.767 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -153.84 142.05 20.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.247 1.019 . . . . 0.0 110.987 -174.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -84.51 -41.1 16.87 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 172.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.1 mp0 -73.4 157.78 36.25 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.064 1.746 . . . . 0.0 111.075 169.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -59.12 118.63 31.5 Favored Pre-proline 0 N--CA 1.476 0.84 0 CA-C-O 118.342 -0.837 . . . . 0.0 108.919 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.61 144.3 97.47 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.121 2.547 . . . . 0.0 112.166 -174.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.6 m 50.74 57.82 6.21 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.83 1.252 . . . . 0.0 112.674 -171.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.242 0 C-N-CA 125.453 1.501 . . . . 0.0 113.707 -179.341 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 77.6 tttt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 119.868 -0.11 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 49.4 mt -133.63 162.06 59.94 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 126.159 1.784 . . . . 0.0 111.495 -175.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.06 171.87 12.94 Favored 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 123.922 3.081 . . . . 0.0 113.108 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -53.13 129.15 32.02 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.61 2.873 . . . . 0.0 114.179 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.48 -19.82 6.72 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 125.536 1.541 . . . . 0.0 116.041 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -76.08 136.73 39.88 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.465 1.632 . . . . 0.0 114.436 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -155.07 144.55 21.26 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.905 1.282 . . . . 0.0 111.579 169.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -58.11 145.16 37.72 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.265 1.426 . . . . 0.0 113.519 177.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.43 170.92 15.04 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 127.093 2.157 . . . . 0.0 110.788 -171.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.0 tpp -154.63 129.8 9.62 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.971 0.908 . . . . 0.0 112.153 -169.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -80.01 156.67 27.05 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 171.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.99 65.99 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -82.12 -0.29 44.06 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 125.363 1.465 . . . . 0.0 114.564 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.25 19.64 54.68 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.485 1.041 . . . . 0.0 115.274 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.7 m -94.72 132.14 39.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.747 1.219 . . . . 0.0 112.066 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -94.69 143.14 12.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 124.362 1.065 . . . . 0.0 109.228 -177.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -147.79 179.97 7.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.861 1.264 . . . . 0.0 110.378 173.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -119.48 139.29 52.32 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.537 1.935 . . . . 0.0 109.534 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -140.34 139.75 35.46 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.249 0.62 . . . . 0.0 112.296 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -100.64 115.52 30.39 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.273 1.029 . . . . 0.0 110.648 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -73.48 -22.22 60.21 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -86.55 -40.16 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 125.409 1.484 . . . . 0.0 111.134 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.8 p -109.77 -7.38 15.05 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 60.54 13.56 4.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.836 2.055 . . . . 0.0 115.391 -176.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.74 153.02 43.95 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.318 1.047 . . . . 0.0 112.157 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.7 p -142.88 149.97 39.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.753 1.221 . . . . 0.0 112.78 178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -149.18 151.66 34.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.803 1.641 . . . . 0.0 112.598 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -84.86 -21.82 29.65 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 169.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -110.07 155.85 21.32 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.533 1.533 . . . . 0.0 110.942 169.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -63.57 148.23 94.32 Favored Pre-proline 0 N--CA 1.474 0.743 0 O-C-N 121.396 -0.815 . . . . 0.0 112.735 -175.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -67.82 150.86 78.89 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.49 2.793 . . . . 0.0 112.195 174.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.6 p -71.01 157.13 38.75 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.393 1.077 . . . . 0.0 113.127 175.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.156 0 C-N-CA 125.131 1.348 . . . . 0.0 112.81 -179.053 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.7 tttt . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 119.436 -0.316 . . . . 0.0 110.928 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.8 mp -71.23 154.39 93.84 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 124.729 1.212 . . . . 0.0 110.844 169.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -68.6 165.85 27.92 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.77 2.98 . . . . 0.0 112.614 173.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -53.94 135.66 64.12 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.762 2.974 . . . . 0.0 114.673 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.69 -22.39 4.09 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.57 1.557 . . . . 0.0 115.809 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -78.89 142.72 36.55 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.496 1.648 . . . . 0.0 113.947 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -152.23 152.09 31.78 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.534 1.934 . . . . 0.0 111.375 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -64.09 145.05 56.6 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.146 -0.971 . . . . 0.0 113.384 174.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.78 164.71 29.37 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.835 2.054 . . . . 0.0 109.968 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.2 ttp -154.74 137.06 14.9 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.528 -0.732 . . . . 0.0 112.64 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -71.54 158.09 36.84 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.186 1.794 . . . . 0.0 115.632 171.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.62 65.98 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -80.14 -3.4 48.72 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.362 1.465 . . . . 0.0 114.471 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.62 21.27 44.41 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.547 1.07 . . . . 0.0 115.382 -177.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.9 m -94.62 124.37 38.61 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.938 1.369 . . . . 0.0 111.249 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.7 t -94.69 142.78 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.274 1.029 . . . . 0.0 110.015 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -149.57 -174.35 4.66 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.117 1.767 . . . . 0.0 109.798 176.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -125.46 142.76 51.33 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.17 1.388 . . . . 0.0 109.871 -176.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.9 133.77 29.04 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.904 1.282 . . . . 0.0 112.8 -169.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -93.41 117.55 30.22 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.271 0.628 . . . . 0.0 110.842 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -74.72 -21.79 59.17 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.4 mt -85.4 -40.13 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.7 1.6 . . . . 0.0 110.987 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.9 p -110.71 -6.47 14.8 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -172.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 60.75 14.9 5.41 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.785 2.034 . . . . 0.0 115.235 -176.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.24 152.42 45.08 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.235 1.014 . . . . 0.0 112.099 172.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.2 p -141.19 147.28 38.1 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.721 1.209 . . . . 0.0 112.009 177.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -157.4 154.4 28.79 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.989 0.915 . . . . 0.0 112.465 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -84.29 -30.83 25.27 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 118.441 2.756 . . . . 0.0 118.441 -177.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -90.1 153.87 20.22 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.872 1.269 . . . . 0.0 111.983 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.1 122.96 80.53 Favored Pre-proline 0 N--CA 1.478 0.963 0 O-C-N 121.323 -0.861 . . . . 0.0 110.914 -176.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.17 155.44 67.87 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.149 2.566 . . . . 0.0 112.388 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.6 t -151.64 153.02 33.64 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.072 1.349 . . . . 0.0 111.512 178.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.135 0 C-N-CA 125.521 1.534 . . . . 0.0 112.912 -176.634 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.1 tptm . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.561 0.22 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.73 156.53 12.23 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 126.081 1.753 . . . . 0.0 112.773 174.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -66.64 166.25 22.72 Favored 'Trans proline' 0 CA--C 1.549 1.244 0 C-N-CA 123.816 3.011 . . . . 0.0 112.828 177.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -53.26 139.62 63.28 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.646 2.897 . . . . 0.0 114.323 -178.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.9 -29.47 2.1 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.527 1.537 . . . . 0.0 115.227 -176.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -81.04 141.72 34.08 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.958 1.379 . . . . 0.0 114.171 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.55 158.32 42.33 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.52 1.528 . . . . 0.0 111.312 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -60.81 145.16 50.88 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 171.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -145.06 162.68 36.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.024 2.129 . . . . 0.0 109.819 -177.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 56.4 ttp -154.82 135.92 13.89 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.417 -0.802 . . . . 0.0 112.649 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -72.37 159.83 33.36 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 115.867 1.802 . . . . 0.0 115.867 174.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -23.26 66.21 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -81.42 -0.5 41.79 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.213 1.405 . . . . 0.0 114.417 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.95 19.47 55.87 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.695 1.14 . . . . 0.0 115.245 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.0 m -94.65 125.59 39.4 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 118.777 1.288 . . . . 0.0 110.632 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.5 t -94.69 141.93 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.422 1.089 . . . . 0.0 109.951 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.8 p90 -150.91 -172.47 4.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.38 1.872 . . . . 0.0 108.417 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -125.78 144.87 50.45 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.57 1.148 . . . . 0.0 108.865 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -140.75 136.44 32.52 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.067 1.347 . . . . 0.0 112.26 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -93.87 115.33 27.71 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.758 0.823 . . . . 0.0 110.487 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -73.51 -21.99 60.24 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.1 mt -86.2 -40.04 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.745 1.618 . . . . 0.0 111.074 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -111.28 -7.13 14.44 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -171.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 60.84 13.75 4.68 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.746 2.018 . . . . 0.0 115.193 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.99 155.54 40.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.149 0.98 . . . . 0.0 112.057 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.7 p -141.93 148.97 39.53 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.699 1.2 . . . . 0.0 112.237 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -150.8 139.8 21.02 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.212 1.405 . . . . 0.0 112.915 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -80.15 -28.46 38.84 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -86.43 148.7 25.44 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.668 1.587 . . . . 0.0 111.73 172.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.3 mmm-85 -57.38 120.88 43.69 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 124.528 1.131 . . . . 0.0 111.406 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.08 151.47 67.28 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.716 2.277 . . . . 0.0 111.25 171.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.4 p -148.67 160.72 42.89 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.089 1.356 . . . . 0.0 112.41 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.157 0 C-N-CA 125.237 1.399 . . . . 0.0 113.071 -179.408 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.4 tttt . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 119.305 -0.378 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 42.9 mt -150.02 164.41 20.8 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 126.772 2.029 . . . . 0.0 110.75 -172.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -67.64 169.45 15.88 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 123.76 2.973 . . . . 0.0 112.947 174.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -53.5 129.28 33.0 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.561 2.841 . . . . 0.0 113.987 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.52 -18.73 10.36 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.538 1.542 . . . . 0.0 116.119 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -74.43 137.8 42.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.645 1.722 . . . . 0.0 114.247 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -153.49 153.5 32.56 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.39 1.876 . . . . 0.0 111.104 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -66.42 145.04 56.13 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 175.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -143.1 162.99 34.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.187 2.195 . . . . 0.0 109.517 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.5 ttp -154.72 136.39 14.37 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 112.668 -175.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -71.7 157.91 37.09 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.102 1.761 . . . . 0.0 115.628 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.18 -22.34 65.82 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -80.15 -3.19 47.9 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.323 1.449 . . . . 0.0 114.427 173.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.34 21.78 43.46 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 124.595 1.093 . . . . 0.0 115.322 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -94.64 123.32 38.01 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 118.798 1.299 . . . . 0.0 111.3 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.79 142.56 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.406 1.083 . . . . 0.0 109.683 -175.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -151.05 -175.74 5.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.073 1.749 . . . . 0.0 109.545 177.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -119.65 141.57 49.22 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.654 1.582 . . . . 0.0 110.949 -177.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -139.06 135.81 34.59 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.742 1.217 . . . . 0.0 112.223 -173.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -96.59 115.25 27.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.554 0.742 . . . . 0.0 110.653 176.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.04 -22.61 60.59 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.9 mt -85.76 -40.07 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 125.454 1.502 . . . . 0.0 110.986 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.0 p -109.48 -7.32 15.19 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.175 1.916 . . . . 0.0 116.175 -171.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.52 13.49 4.21 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.936 2.094 . . . . 0.0 115.298 -175.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.21 153.33 43.85 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.187 0.995 . . . . 0.0 112.258 173.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 86.9 p -138.72 148.87 44.45 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.893 1.277 . . . . 0.0 112.052 176.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -157.61 145.91 19.15 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.674 1.19 . . . . 0.0 112.004 -175.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -89.72 -44.48 9.98 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -75.1 122.87 24.23 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.102 0.961 . . . . 0.0 110.302 174.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -58.74 136.15 86.71 Favored Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -169.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -62.69 154.92 62.28 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.319 2.679 . . . . 0.0 112.38 171.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.9 t -70.58 137.47 50.07 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.458 -0.776 . . . . 0.0 111.903 176.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.276 0 CA-C-O 117.163 -1.91 . . . . 0.0 114.69 179.414 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 119.611 -0.233 . . . . 0.0 111.503 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 46.5 mt -134.85 162.72 56.02 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.719 2.008 . . . . 0.0 111.132 -178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -66.97 168.97 15.85 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 123.729 2.952 . . . . 0.0 112.955 175.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -52.41 126.84 21.9 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.565 2.844 . . . . 0.0 113.948 -178.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.36 -21.58 7.09 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 125.591 1.567 . . . . 0.0 116.122 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -73.21 133.24 43.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.875 1.838 . . . . 0.0 113.836 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -144.23 161.69 38.25 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.511 1.924 . . . . 0.0 111.484 173.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -65.49 145.2 56.42 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -143.78 164.09 31.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.216 2.206 . . . . 0.0 109.585 -175.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 77.1 mtm -154.45 136.9 15.0 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -79.6 156.42 27.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.296 1.838 . . . . 0.0 115.441 172.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.34 66.44 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.2 p30 -79.91 -2.95 45.97 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.337 1.455 . . . . 0.0 114.58 174.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.29 20.9 43.4 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.548 1.071 . . . . 0.0 115.444 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.7 m -94.63 134.58 37.05 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.788 1.294 . . . . 0.0 111.63 177.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.7 t -94.71 141.55 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.996 1.318 . . . . 0.0 110.961 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.37 -172.11 4.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.494 1.517 . . . . 0.0 108.718 172.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.38 142.29 51.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.662 1.585 . . . . 0.0 110.392 -176.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.37 134.94 31.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.604 1.161 . . . . 0.0 112.525 -172.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -95.47 113.66 25.35 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.784 0.833 . . . . 0.0 110.614 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -72.53 -22.06 61.09 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.5 -40.11 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.482 1.513 . . . . 0.0 111.062 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -109.51 -6.9 15.25 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 116.177 1.918 . . . . 0.0 116.177 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.62 13.58 4.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.886 2.074 . . . . 0.0 115.276 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.57 153.63 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.158 0.983 . . . . 0.0 112.256 172.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.8 p -140.44 147.0 39.01 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.009 1.324 . . . . 0.0 112.026 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -154.13 143.61 21.52 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.839 0.856 . . . . 0.0 111.915 -175.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -83.56 -38.7 21.33 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 175.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -79.81 152.3 29.81 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.294 0.638 . . . . 0.0 109.815 169.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -70.12 137.48 87.01 Favored Pre-proline 0 CA--C 1.542 0.642 0 O-C-N 121.574 -0.704 . . . . 0.0 111.903 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -60.05 148.22 90.02 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.483 2.788 . . . . 0.0 111.847 169.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.7 p 48.45 38.03 10.05 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 126.214 1.806 . . . . 0.0 115.4 177.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.29 0 C-N-CA 125.059 1.314 . . . . 0.0 113.896 178.4 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 N--CA 1.488 1.429 0 N-CA-C 111.536 0.198 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 17.9 mt -135.08 164.46 43.76 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 126.687 1.995 . . . . 0.0 111.368 -173.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -66.35 169.67 13.54 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.603 2.868 . . . . 0.0 112.859 176.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -51.74 121.66 9.02 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.741 2.961 . . . . 0.0 114.451 -174.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.82 -17.16 22.87 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 125.712 1.625 . . . . 0.0 116.161 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -73.36 139.0 45.69 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.88 1.84 . . . . 0.0 114.209 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.63 152.71 33.2 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.942 1.697 . . . . 0.0 111.42 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -63.72 145.12 56.35 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -146.08 162.18 38.49 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.577 1.951 . . . . 0.0 109.655 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.4 ptm -154.87 140.25 17.72 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.33 156.02 40.0 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.1 1.76 . . . . 0.0 114.885 172.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.06 -21.48 66.19 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -78.29 -3.47 43.08 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.187 1.395 . . . . 0.0 114.435 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.65 20.2 41.5 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 124.601 1.096 . . . . 0.0 115.199 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.2 m -94.62 125.08 39.04 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.867 1.333 . . . . 0.0 111.592 177.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.1 t -94.74 142.49 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.539 1.136 . . . . 0.0 110.348 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -149.46 -172.59 4.17 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.372 1.869 . . . . 0.0 109.359 175.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -127.54 144.16 51.1 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.476 1.511 . . . . 0.0 110.321 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -135.98 137.09 40.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.904 1.281 . . . . 0.0 111.247 -176.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -97.42 115.76 28.36 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.465 0.706 . . . . 0.0 110.85 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -72.89 -24.09 60.81 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.55 -40.23 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.479 1.512 . . . . 0.0 111.089 -178.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.8 p -110.15 -3.53 16.3 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -170.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.319 16.3 p30 53.84 15.04 0.74 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 128.271 2.628 . . . . 0.0 116.071 -174.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.27 156.22 39.11 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.62 1.168 . . . . 0.0 112.308 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.6 p -136.76 149.64 47.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.797 1.239 . . . . 0.0 111.763 173.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -155.8 145.38 21.07 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.539 1.136 . . . . 0.0 111.584 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -89.56 -38.69 13.79 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -76.8 134.9 38.96 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.433 1.093 . . . . 0.0 111.722 175.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.92 110.23 2.05 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.401 1.481 . . . . 0.0 112.312 -174.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -60.87 147.83 94.17 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.886 3.058 . . . . 0.0 115.733 -169.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.5 t -150.21 154.65 38.33 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.94 1.296 . . . . 0.0 111.491 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.144 0 C-N-CA 125.513 1.53 . . . . 0.0 112.805 -177.427 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 tptm . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 110.604 -0.146 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.48 149.28 61.56 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.356 1.462 . . . . 0.0 112.12 177.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -69.72 166.7 26.65 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.28 3.32 . . . . 0.0 112.419 172.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -54.26 140.06 72.46 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.832 3.021 . . . . 0.0 114.446 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.27 -24.65 3.45 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 125.578 1.561 . . . . 0.0 115.564 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -79.81 146.12 32.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.223 1.511 . . . . 0.0 114.107 177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -145.6 157.99 43.9 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.158 2.183 . . . . 0.0 111.581 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -75.75 145.12 41.05 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.774 -0.579 . . . . 0.0 111.347 169.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -146.9 164.29 33.37 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.525 1.53 . . . . 0.0 110.103 -177.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.1 ttm -154.66 135.59 13.76 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.383 -0.823 . . . . 0.0 112.552 -171.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -72.25 158.13 36.42 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.39 1.876 . . . . 0.0 115.6 172.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.21 65.38 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.87 -3.33 50.91 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.424 1.49 . . . . 0.0 114.55 174.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.8 20.92 45.09 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.658 1.123 . . . . 0.0 115.443 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.57 128.55 41.27 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 118.916 1.358 . . . . 0.0 111.289 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.3 t -94.71 142.86 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.185 0.994 . . . . 0.0 110.039 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -148.66 -175.29 4.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.336 1.854 . . . . 0.0 109.274 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -125.2 143.88 50.73 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.179 1.392 . . . . 0.0 110.277 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -141.49 136.93 31.72 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.466 1.107 . . . . 0.0 110.494 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -96.24 119.1 34.13 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.536 0.735 . . . . 0.0 111.081 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -73.75 -23.52 59.76 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.0 mt -84.24 -40.23 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.852 1.661 . . . . 0.0 111.016 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -112.7 -3.01 14.34 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -170.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.327 15.8 p30 53.87 16.84 1.15 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.933 2.493 . . . . 0.0 116.046 -174.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.51 154.75 39.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.417 1.087 . . . . 0.0 111.906 171.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.2 p -144.49 146.57 32.49 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.361 1.064 . . . . 0.0 112.087 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -157.71 156.13 31.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.102 0.961 . . . . 0.0 112.3 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -85.4 -28.72 24.94 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 118.499 2.778 . . . . 0.0 118.499 -177.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -92.37 153.07 19.41 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.949 1.3 . . . . 0.0 112.162 176.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.2 ttp180 -62.82 124.4 83.27 Favored Pre-proline 0 N--CA 1.476 0.87 0 O-C-N 121.375 -0.828 . . . . 0.0 111.329 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -63.28 160.21 36.01 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.579 2.853 . . . . 0.0 114.027 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.9 p -149.04 158.97 44.6 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.329 1.451 . . . . 0.0 112.334 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.219 0 C-N-CA 125.36 1.457 . . . . 0.0 113.342 -177.093 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.5 tptt . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.747 0.308 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 44.2 mt -58.25 162.82 5.33 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 126.23 1.812 . . . . 0.0 113.331 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -66.71 170.91 11.68 Favored 'Trans proline' 0 CA--C 1.549 1.229 0 C-N-CA 123.559 2.839 . . . . 0.0 113.108 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -51.57 121.81 9.18 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.737 2.958 . . . . 0.0 114.636 -174.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.8 -16.09 22.45 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 125.682 1.61 . . . . 0.0 116.154 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -73.56 140.12 46.07 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.918 1.859 . . . . 0.0 114.189 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -149.46 154.79 39.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.674 1.59 . . . . 0.0 110.693 174.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -64.13 145.1 56.52 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 173.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -144.18 163.64 33.02 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.16 2.184 . . . . 0.0 109.651 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 54.1 ttp -154.71 136.33 14.33 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.205 -0.934 . . . . 0.0 112.696 -176.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -72.1 158.04 36.66 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.194 1.798 . . . . 0.0 115.792 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.07 -22.94 66.18 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.4 p30 -80.09 -2.94 46.61 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.302 1.441 . . . . 0.0 114.43 173.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.52 20.61 47.42 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.745 1.164 . . . . 0.0 115.4 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 54.4 m -94.63 124.78 38.87 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 118.941 1.371 . . . . 0.0 111.043 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -94.64 141.91 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.391 1.076 . . . . 0.0 109.395 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.76 -170.32 3.62 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.201 1.8 . . . . 0.0 108.403 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -126.02 143.97 50.9 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.445 1.498 . . . . 0.0 110.163 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -135.69 134.88 39.61 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.163 1.385 . . . . 0.0 112.098 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -95.61 115.22 27.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.436 0.694 . . . . 0.0 110.69 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -73.41 -23.21 60.11 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -85.1 -40.1 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.371 1.468 . . . . 0.0 111.101 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.0 p -108.74 -7.36 15.59 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 60.26 13.64 4.08 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.005 2.122 . . . . 0.0 115.357 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.71 154.53 41.29 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.364 1.065 . . . . 0.0 112.404 173.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -132.95 148.33 52.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.166 1.387 . . . . 0.0 111.689 173.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -156.75 143.19 18.3 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.588 1.155 . . . . 0.0 112.0 -170.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.267 63.4 m-85 -89.86 -56.41 3.25 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 118.604 2.816 . . . . 0.0 118.604 -175.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -74.08 155.0 38.95 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.313 1.045 . . . . 0.0 111.106 171.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -54.96 118.49 17.59 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 124.515 1.126 . . . . 0.0 110.885 -173.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -54.78 137.47 74.81 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 123.823 3.016 . . . . 0.0 113.284 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.8 m 50.86 57.54 6.53 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.732 1.213 . . . . 0.0 112.739 -171.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.268 0 C-N-CA 125.473 1.511 . . . . 0.0 113.711 -178.901 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.4 mt 60.58 165.03 0.1 OUTLIER Pre-proline 0 CA--C 1.557 1.239 0 C-N-CA 127.378 2.271 . . . . 0.0 114.953 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -68.1 168.76 18.19 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 C-N-CA 123.17 2.58 . . . . 0.0 112.546 173.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -52.81 123.19 12.44 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.643 2.895 . . . . 0.0 114.285 -175.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.58 -16.92 22.72 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.538 1.542 . . . . 0.0 116.262 179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -73.83 140.31 45.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.94 1.87 . . . . 0.0 114.175 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -152.27 150.46 29.8 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.403 1.881 . . . . 0.0 111.238 178.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -66.95 145.05 55.83 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.69 167.09 22.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 127.262 2.225 . . . . 0.0 110.05 -175.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.3 ttm -154.72 134.57 12.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.617 -0.677 . . . . 0.0 112.574 -174.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -71.29 158.55 36.17 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.47 1.908 . . . . 0.0 115.994 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.47 -23.04 65.6 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.3 p30 -81.3 -2.73 50.16 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.278 1.431 . . . . 0.0 114.515 174.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.74 19.75 50.27 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.731 1.158 . . . . 0.0 115.511 -178.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 59.9 m -94.7 131.07 40.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 118.995 1.397 . . . . 0.0 111.253 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.4 t -94.65 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.337 1.055 . . . . 0.0 109.986 -176.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.3 -176.17 5.27 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.949 1.7 . . . . 0.0 109.536 174.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.53 144.69 48.57 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.703 1.601 . . . . 0.0 110.237 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -139.36 135.72 34.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.898 1.279 . . . . 0.0 111.968 -175.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -97.02 116.77 29.81 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.283 0.633 . . . . 0.0 110.799 175.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -74.01 -22.95 59.39 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -176.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.9 mt -85.06 -40.17 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.502 1.521 . . . . 0.0 110.989 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.0 p -110.18 -6.12 15.15 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -171.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 60.17 14.76 4.74 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.796 2.038 . . . . 0.0 115.267 -175.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.56 152.27 45.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.211 1.004 . . . . 0.0 112.183 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.0 p -140.24 142.26 35.82 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.981 1.312 . . . . 0.0 111.914 177.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -155.08 146.39 22.91 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.181 0.993 . . . . 0.0 111.915 -174.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -84.9 -40.18 17.34 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 176.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.13 151.57 41.52 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.958 1.303 . . . . 0.0 111.942 170.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -61.01 125.21 83.14 Favored Pre-proline 0 CA--C 1.548 0.866 0 O-C-N 121.273 -0.892 . . . . 0.0 110.199 177.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -53.25 137.95 63.91 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.954 3.103 . . . . 0.0 113.647 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.5 t -69.14 133.36 47.91 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.978 0.911 . . . . 0.0 112.808 -171.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.24 0 C-N-CA 125.577 1.56 . . . . 0.0 112.769 -176.318 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 119.486 -0.292 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.2 mp 60.88 143.4 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.257 0 C-N-CA 128.898 2.879 . . . . 0.0 114.263 -175.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -77.23 167.57 24.53 Favored 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 123.864 3.042 . . . . 0.0 111.865 172.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -54.42 137.98 72.93 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.571 2.847 . . . . 0.0 114.587 -175.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.25 -24.69 5.32 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 125.541 1.543 . . . . 0.0 115.653 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -76.9 140.96 40.71 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 119.461 1.631 . . . . 0.0 113.785 178.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -153.48 154.38 34.27 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.945 1.698 . . . . 0.0 111.438 176.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -57.01 145.36 30.69 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -146.93 164.34 33.25 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.685 1.994 . . . . 0.0 110.5 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 53.1 ttp -154.79 135.84 13.86 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.61 -0.681 . . . . 0.0 112.615 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -71.05 158.15 36.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.192 1.797 . . . . 0.0 115.65 172.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.98 65.99 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.2 p30 -80.36 -3.08 48.18 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.349 1.46 . . . . 0.0 114.455 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.01 20.07 48.09 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.737 1.16 . . . . 0.0 115.416 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 56.1 m -94.68 126.11 39.77 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 119.026 1.413 . . . . 0.0 111.16 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.5 t -94.68 142.26 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.279 1.031 . . . . 0.0 109.85 -174.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -150.34 -173.05 4.33 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.192 1.797 . . . . 0.0 109.032 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -128.16 141.73 51.39 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.38 1.472 . . . . 0.0 109.034 -175.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -137.98 134.16 34.55 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.831 1.253 . . . . 0.0 112.126 -170.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -92.97 114.73 27.37 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 110.678 177.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.03 -22.67 60.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.7 mt -85.13 -40.18 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 111.056 -177.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 p -111.76 -6.81 14.27 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -171.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 60.76 14.13 4.87 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.766 2.026 . . . . 0.0 115.193 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.95 155.57 39.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.088 0.955 . . . . 0.0 112.217 172.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 70.8 p -141.91 145.32 34.43 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.868 1.267 . . . . 0.0 111.993 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -152.14 142.72 22.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.297 1.039 . . . . 0.0 111.703 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -79.99 -36.0 36.62 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 117.167 2.284 . . . . 0.0 117.167 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -80.85 146.43 30.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.222 1.409 . . . . 0.0 111.826 172.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.45 119.27 58.35 Favored Pre-proline 0 N--CA 1.474 0.725 0 C-N-CA 123.799 0.84 . . . . 0.0 110.218 179.078 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.59 144.83 50.65 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.631 2.221 . . . . 0.0 112.116 -176.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.8 m -72.26 129.87 39.46 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.943 1.297 . . . . 0.0 113.806 -172.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.397 0 C-N-CA 126.174 1.845 . . . . 0.0 114.005 -177.518 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.1 tmmm? . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 119.384 -0.341 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 24.7 mt -127.9 162.97 46.46 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 126.302 1.841 . . . . 0.0 110.745 171.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -65.21 167.53 16.17 Favored 'Trans proline' 0 CA--C 1.548 1.223 0 C-N-CA 123.292 2.661 . . . . 0.0 113.013 176.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -52.51 122.41 10.78 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.647 2.898 . . . . 0.0 114.169 -175.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.61 -17.5 19.91 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 125.58 1.562 . . . . 0.0 116.15 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -73.66 135.79 43.78 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.943 1.872 . . . . 0.0 113.832 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -145.66 163.75 33.89 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.904 1.682 . . . . 0.0 112.243 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.43 145.12 56.59 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 172.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -143.5 161.67 37.83 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.213 2.205 . . . . 0.0 109.769 -176.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.7 ttt -154.77 131.37 10.6 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -171.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -77.69 155.09 31.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.589 1.955 . . . . 0.0 115.514 175.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -22.36 66.82 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -79.94 -0.79 36.58 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.61 13.14 56.02 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 124.701 1.144 . . . . 0.0 115.418 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 30.9 m -94.68 127.56 40.75 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.863 1.331 . . . . 0.0 112.343 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.79 142.98 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.475 1.11 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -149.62 -169.02 3.27 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.328 1.851 . . . . 0.0 108.83 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -127.46 145.37 50.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.573 1.549 . . . . 0.0 110.429 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -141.2 134.63 29.79 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.107 1.363 . . . . 0.0 112.241 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -94.73 115.78 27.94 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.726 176.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.71 -22.42 59.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.6 mt -85.68 -40.13 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.508 1.523 . . . . 0.0 111.08 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -110.49 -6.02 15.01 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -171.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.35 14.66 4.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.819 2.047 . . . . 0.0 115.302 -176.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.75 152.51 45.23 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.146 0.979 . . . . 0.0 112.161 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 56.6 p -139.8 144.24 37.26 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.99 1.316 . . . . 0.0 111.986 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -156.79 143.76 18.66 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.455 1.102 . . . . 0.0 111.049 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.253 43.3 t80 -85.19 -39.22 18.08 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 177.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.91 141.64 51.15 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.332 1.053 . . . . 0.0 112.225 171.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.34 116.03 20.1 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.273 1.029 . . . . 0.0 111.895 -177.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -59.44 126.17 20.0 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.563 2.842 . . . . 0.0 114.77 -171.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 56.3 m 53.9 40.91 32.09 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.532 1.533 . . . . 0.0 114.928 175.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 CA-C-O 118.223 -1.32 . . . . 0.0 113.769 176.71 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 25.7 mt -124.3 163.64 34.9 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.376 1.871 . . . . 0.0 111.569 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -67.04 170.15 13.6 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 C-N-CA 123.917 3.078 . . . . 0.0 112.835 174.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -52.68 127.81 25.88 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.678 2.919 . . . . 0.0 114.035 -177.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.69 -21.27 5.56 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.592 1.567 . . . . 0.0 116.075 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -73.72 138.23 44.51 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.72 1.76 . . . . 0.0 113.943 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.72 154.7 36.82 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.157 1.783 . . . . 0.0 111.205 175.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -62.55 145.02 55.39 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -144.11 163.54 33.28 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.169 2.188 . . . . 0.0 109.74 -176.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.1 ttm -154.71 135.06 13.28 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.412 -0.805 . . . . 0.0 112.521 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -71.25 158.14 36.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.271 1.828 . . . . 0.0 115.81 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -22.57 65.42 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.83 -3.32 50.72 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.396 1.478 . . . . 0.0 114.505 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.83 21.03 44.5 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 124.721 1.153 . . . . 0.0 115.448 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.2 m -94.61 127.03 40.29 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.999 1.4 . . . . 0.0 111.237 178.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.6 t -94.65 142.96 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.431 1.092 . . . . 0.0 110.359 -176.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -151.39 -175.61 5.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.114 1.765 . . . . 0.0 109.199 175.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -118.93 142.67 47.56 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.955 1.302 . . . . 0.0 110.351 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -135.94 134.59 38.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.243 1.417 . . . . 0.0 112.706 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -96.31 114.62 26.32 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.432 0.693 . . . . 0.0 110.77 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -73.41 -22.84 60.13 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.6 mt -85.14 -40.16 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.357 1.463 . . . . 0.0 111.048 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 p -108.62 -7.04 15.76 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -172.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.41 13.29 3.98 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.922 2.089 . . . . 0.0 115.313 -175.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.66 152.63 45.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.055 0.942 . . . . 0.0 112.116 173.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.1 p -138.8 145.46 40.14 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.6 1.16 . . . . 0.0 111.482 174.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -157.05 143.81 18.4 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.092 0.957 . . . . 0.0 112.286 -174.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -84.71 -38.26 19.94 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 176.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -69.32 150.45 47.34 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.515 1.126 . . . . 0.0 111.786 171.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.98 123.45 80.09 Favored Pre-proline 0 N--CA 1.476 0.871 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.774 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -61.51 157.18 42.73 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.201 2.601 . . . . 0.0 113.165 172.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.2 m -158.12 154.66 27.83 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.507 1.523 . . . . 0.0 112.368 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.165 0 C-N-CA 125.144 1.354 . . . . 0.0 112.774 -179.637 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 66.7 mt -128.2 161.39 56.65 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 126.014 1.726 . . . . 0.0 111.834 -172.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -67.58 170.16 14.34 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.574 2.849 . . . . 0.0 112.805 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -52.09 122.87 11.33 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.7 2.933 . . . . 0.0 114.323 -175.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.43 -17.45 19.19 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.623 1.582 . . . . 0.0 116.239 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -73.17 139.08 46.09 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.807 1.804 . . . . 0.0 114.088 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.79 152.09 33.29 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.807 1.643 . . . . 0.0 111.434 174.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -59.75 145.41 45.27 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 175.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -146.5 163.08 36.86 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.56 1.944 . . . . 0.0 110.592 -178.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.6 ptp -154.91 140.1 17.54 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -178.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.0 156.76 37.2 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.584 1.953 . . . . 0.0 115.221 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -22.03 66.27 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.7 p30 -79.0 -3.18 43.79 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.23 1.412 . . . . 0.0 114.593 174.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.24 19.16 47.11 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.675 1.131 . . . . 0.0 115.469 -178.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.5 m -94.59 129.75 41.3 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 118.834 1.317 . . . . 0.0 111.613 177.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.73 142.96 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.566 1.147 . . . . 0.0 110.299 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -149.18 -171.76 3.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.307 1.843 . . . . 0.0 108.81 174.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -128.49 143.9 51.05 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.449 1.5 . . . . 0.0 109.885 -177.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -134.15 134.56 42.3 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.21 1.404 . . . . 0.0 112.251 -176.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -96.13 115.0 26.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.476 0.71 . . . . 0.0 110.821 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.48 -22.99 60.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -85.33 -40.09 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.3 1.44 . . . . 0.0 111.053 -178.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.72 -6.85 15.74 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 60.23 13.73 4.11 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.991 2.116 . . . . 0.0 115.296 -175.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.85 153.08 43.78 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.248 1.019 . . . . 0.0 112.343 173.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.9 p -137.04 141.19 42.46 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.15 1.38 . . . . 0.0 111.496 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -153.39 144.02 22.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.158 0.983 . . . . 0.0 112.28 -172.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -83.01 -39.73 20.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 178.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -81.66 145.63 30.47 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.33 1.052 . . . . 0.0 112.199 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.67 113.31 5.77 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.978 1.311 . . . . 0.0 111.914 -176.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -60.19 129.34 29.66 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 123.706 2.937 . . . . 0.0 114.871 -170.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.6 m -86.64 148.84 25.29 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.313 1.045 . . . . 0.0 112.927 176.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.173 0 C-N-CA 125.135 1.35 . . . . 0.0 112.76 179.848 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.9 tttp . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 119.657 -0.211 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.9 mp -65.74 153.71 90.36 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 124.691 1.197 . . . . 0.0 111.579 177.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -66.59 162.08 38.56 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.415 2.744 . . . . 0.0 112.563 172.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.49 135.86 71.18 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 123.458 2.772 . . . . 0.0 114.049 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.79 -14.6 18.28 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.165 1.365 . . . . 0.0 116.198 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.0 m95 -85.22 144.54 28.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 118.706 1.253 . . . . 0.0 113.407 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.25 150.5 33.81 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.835 1.654 . . . . 0.0 111.23 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -65.82 145.04 56.44 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 176.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -144.75 165.83 26.96 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.233 2.213 . . . . 0.0 109.571 -175.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -154.79 135.86 13.86 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.291 -0.881 . . . . 0.0 112.511 -173.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -70.37 158.07 36.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.282 1.833 . . . . 0.0 115.629 172.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.48 -22.88 65.48 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -81.31 -3.32 52.22 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.415 1.486 . . . . 0.0 114.632 174.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.95 19.59 46.57 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.631 1.11 . . . . 0.0 115.614 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.3 m -94.6 128.43 41.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 118.969 1.384 . . . . 0.0 111.349 178.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.57 143.86 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.359 1.064 . . . . 0.0 110.213 -174.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -150.71 -172.97 4.33 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.968 1.707 . . . . 0.0 109.759 175.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -124.67 143.7 50.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.064 1.746 . . . . 0.0 110.007 -175.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -140.76 132.7 27.66 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.838 1.255 . . . . 0.0 111.568 -170.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -91.46 120.71 32.52 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.371 0.669 . . . . 0.0 110.685 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -77.13 -20.16 55.96 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -172.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.8 mp -86.06 -40.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.818 1.247 . . . . 0.0 111.741 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 p -108.95 -7.31 15.43 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -170.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.1 m-80 59.91 16.11 5.48 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.521 1.928 . . . . 0.0 114.814 -175.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.54 152.93 44.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.955 0.902 . . . . 0.0 111.837 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.7 p -136.72 148.24 47.2 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.621 1.169 . . . . 0.0 112.265 178.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.2 tp60 -156.25 142.42 18.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.357 1.463 . . . . 0.0 111.348 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.345 53.1 t80 -87.17 -49.76 7.07 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 118.815 2.894 . . . . 0.0 118.815 -171.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -88.08 151.01 23.04 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.031 0.933 . . . . 0.0 110.849 169.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 ttp180 -54.87 121.34 34.34 Favored Pre-proline 0 N--CA 1.48 1.034 0 CA-C-N 119.056 0.844 . . . . 0.0 111.53 -169.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -62.96 148.21 93.72 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.991 2.46 . . . . 0.0 112.313 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.7 p -67.56 141.47 56.82 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -170.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.755 1.645 . . . . 0.0 112.491 -174.43 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 119.837 -0.125 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 72.8 mt -120.81 162.45 34.8 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 126.392 1.877 . . . . 0.0 111.327 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.36 172.66 11.85 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 123.289 2.659 . . . . 0.0 112.998 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -52.19 124.15 14.22 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.629 2.886 . . . . 0.0 114.256 -176.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.66 -16.61 18.76 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.538 1.542 . . . . 0.0 116.148 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -74.85 139.3 43.1 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.767 1.784 . . . . 0.0 114.048 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.85 154.1 36.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.994 1.718 . . . . 0.0 111.108 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -61.97 145.14 53.85 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 175.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpt85 -142.82 163.05 33.85 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.281 2.232 . . . . 0.0 109.468 -175.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 50.8 ttp -154.78 136.1 14.07 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.348 -0.845 . . . . 0.0 112.853 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -70.49 157.72 37.35 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.161 1.784 . . . . 0.0 115.365 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.02 -22.42 65.7 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.6 -3.51 50.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.437 1.495 . . . . 0.0 114.631 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.75 43.71 Favored Glycine 0 CA--C 1.539 1.538 0 C-N-CA 124.6 1.095 . . . . 0.0 115.397 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.1 m -94.59 124.62 38.73 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.948 1.374 . . . . 0.0 111.482 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.4 t -94.75 142.81 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.346 1.059 . . . . 0.0 110.067 -173.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -149.47 -171.86 3.99 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.373 1.869 . . . . 0.0 109.639 176.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -123.59 142.42 51.05 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.668 1.587 . . . . 0.0 109.93 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -136.87 135.22 37.68 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.933 1.293 . . . . 0.0 112.652 -176.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -96.17 114.89 26.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.55 0.74 . . . . 0.0 110.757 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -73.82 -23.63 59.69 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.8 mt -84.8 -40.08 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.336 1.454 . . . . 0.0 111.07 -178.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.93 -7.47 15.42 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.18 1.918 . . . . 0.0 116.18 -171.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.27 15.37 5.29 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.802 2.041 . . . . 0.0 113.923 -175.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.67 155.64 40.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.052 -1.03 . . . . 0.0 112.08 172.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.1 p -141.18 150.03 42.23 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.641 1.176 . . . . 0.0 111.938 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -155.0 139.78 17.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.622 1.169 . . . . 0.0 111.3 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -78.86 -30.68 45.22 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 169.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -78.49 142.11 37.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.516 1.126 . . . . 0.0 111.858 171.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.04 120.09 54.58 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.113 0.965 . . . . 0.0 110.918 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.31 133.11 17.25 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.378 2.719 . . . . 0.0 113.378 -169.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t 58.97 175.8 0.07 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.53 1.932 . . . . 0.0 114.145 -174.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.265 0 C-N-CA 125.769 1.652 . . . . 0.0 112.843 -178.419 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 119.473 -0.299 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 80.7 mt -75.33 163.37 68.13 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 124.604 1.161 . . . . 0.0 111.518 169.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -69.14 167.76 22.7 Favored 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 123.346 2.697 . . . . 0.0 112.523 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -53.26 122.9 12.01 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.516 2.811 . . . . 0.0 113.937 -175.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.11 -15.14 45.86 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.474 1.512 . . . . 0.0 116.287 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -73.76 134.94 43.53 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 120.002 1.901 . . . . 0.0 114.109 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -145.51 162.04 38.33 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.85 2.06 . . . . 0.0 111.444 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -69.8 145.09 52.42 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.442 -0.786 . . . . 0.0 112.994 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -143.24 165.2 28.12 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.291 2.236 . . . . 0.0 109.835 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.2 ttm -154.63 134.25 12.78 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.362 -0.836 . . . . 0.0 112.512 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -71.26 158.58 36.14 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.334 1.853 . . . . 0.0 115.438 172.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.89 -22.44 65.56 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -81.0 -3.66 52.47 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.439 1.496 . . . . 0.0 114.625 174.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.04 22.24 39.19 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.538 1.066 . . . . 0.0 115.331 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.9 m -94.59 126.95 40.21 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.902 1.351 . . . . 0.0 111.116 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.7 t -94.69 142.67 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.195 0.998 . . . . 0.0 109.954 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -151.83 -174.29 4.81 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.947 1.699 . . . . 0.0 108.801 176.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -120.51 143.65 48.44 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.47 1.508 . . . . 0.0 110.637 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -142.66 136.11 28.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.598 1.159 . . . . 0.0 111.561 -172.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -94.77 117.0 29.42 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.252 0.621 . . . . 0.0 110.814 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -72.69 -22.98 60.82 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.3 mt -86.09 -40.08 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.708 1.603 . . . . 0.0 111.102 -177.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -112.12 -3.55 14.67 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.272 1.953 . . . . 0.0 116.272 -170.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.331 15.7 p30 53.69 17.36 1.21 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.89 2.476 . . . . 0.0 115.979 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.2 152.68 44.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.338 1.055 . . . . 0.0 111.931 170.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.6 p -141.02 148.65 40.62 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.8 1.24 . . . . 0.0 112.154 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -158.64 146.27 17.94 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.585 1.154 . . . . 0.0 111.804 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -84.36 -39.35 19.19 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -72.47 152.2 42.07 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.253 1.021 . . . . 0.0 111.939 170.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -66.12 127.3 93.12 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.68 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -59.4 165.69 8.87 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 123.925 3.083 . . . . 0.0 114.818 175.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.5 m -59.22 147.17 36.49 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.408 1.483 . . . . 0.0 114.829 -172.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.274 0 CA-C-O 117.661 -1.633 . . . . 0.0 112.752 -179.017 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.7 pttm . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.3 mp -107.39 159.08 31.5 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 126.201 1.8 . . . . 0.0 111.87 -176.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -65.09 165.61 21.24 Favored 'Trans proline' 0 CA--C 1.549 1.238 0 C-N-CA 123.965 3.11 . . . . 0.0 112.992 175.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -52.65 129.25 31.49 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 123.747 2.964 . . . . 0.0 114.826 -171.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.24 -22.44 3.73 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 125.705 1.622 . . . . 0.0 115.795 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -75.1 138.97 42.46 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.637 1.718 . . . . 0.0 113.771 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -147.37 165.52 29.94 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.685 1.994 . . . . 0.0 112.054 176.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -65.68 145.19 56.33 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -144.24 162.3 36.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.983 2.113 . . . . 0.0 110.082 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.3 ttp -154.73 137.24 15.07 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.439 -0.788 . . . . 0.0 112.811 -177.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -71.09 157.99 37.24 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.179 1.792 . . . . 0.0 115.461 172.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -23.09 65.88 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 p30 -81.02 -3.19 50.92 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.349 1.46 . . . . 0.0 114.537 174.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.43 19.99 46.87 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.61 1.1 . . . . 0.0 115.5 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.9 m -94.62 126.14 39.72 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.952 1.376 . . . . 0.0 111.344 177.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.0 t -94.65 142.12 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.255 1.022 . . . . 0.0 110.175 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -148.43 -168.73 3.17 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.55 1.94 . . . . 0.0 108.83 174.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -130.32 147.11 51.99 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.512 1.125 . . . . 0.0 109.591 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -142.48 134.59 27.38 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.56 1.544 . . . . 0.0 112.473 -169.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -92.96 116.17 28.8 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.331 0.653 . . . . 0.0 110.875 175.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -73.77 -22.01 59.99 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -176.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.6 mt -86.31 -40.19 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.668 1.587 . . . . 0.0 111.133 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 p -110.39 -6.26 15.01 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -171.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 60.52 14.82 5.12 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.783 2.033 . . . . 0.0 115.239 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.0 152.49 45.19 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.244 1.018 . . . . 0.0 111.984 172.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.1 p -140.38 143.73 35.85 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.925 1.29 . . . . 0.0 112.139 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -155.84 141.72 18.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.418 1.087 . . . . 0.0 111.145 -177.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.254 43.3 t80 -80.48 -37.01 32.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 177.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -70.65 145.36 50.68 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.48 1.112 . . . . 0.0 112.314 169.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.69 116.21 24.63 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.74 1.216 . . . . 0.0 111.165 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.23 148.01 38.42 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.7 2.933 . . . . 0.0 113.433 -169.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.4 p -154.31 162.47 41.15 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.822 1.249 . . . . 0.0 112.306 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.151 0 C-N-CA 125.167 1.365 . . . . 0.0 112.848 -178.964 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.3 tmmm? . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 45.9 mt 60.47 163.12 0.1 Allowed Pre-proline 0 CA--C 1.558 1.268 0 C-N-CA 127.385 2.274 . . . . 0.0 114.399 -171.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -68.46 170.5 14.81 Favored 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 123.493 2.795 . . . . 0.0 112.654 174.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -51.93 122.19 10.06 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.792 2.995 . . . . 0.0 114.447 -175.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.18 -17.62 17.12 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.678 1.609 . . . . 0.0 116.228 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -74.09 139.91 44.94 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.866 1.833 . . . . 0.0 114.028 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.04 155.72 38.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.055 1.742 . . . . 0.0 110.606 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.49 145.07 56.58 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.096 -1.002 . . . . 0.0 113.335 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -144.53 162.36 36.78 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.058 2.143 . . . . 0.0 109.648 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.8 ptp -154.82 140.11 17.64 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -72.77 159.12 34.3 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.302 1.841 . . . . 0.0 115.347 174.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.39 -22.77 66.4 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 178.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 p30 -80.27 -0.71 37.66 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.156 1.383 . . . . 0.0 114.491 173.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.12 18.76 55.17 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.664 1.126 . . . . 0.0 115.371 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.9 m -94.73 128.3 41.33 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.678 1.239 . . . . 0.0 110.974 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.3 t -94.7 143.2 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.644 1.178 . . . . 0.0 110.429 -176.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -150.49 -173.57 4.5 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.27 1.828 . . . . 0.0 109.036 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -122.54 141.89 51.2 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.172 1.389 . . . . 0.0 110.547 -178.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -136.6 135.5 38.42 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.942 1.297 . . . . 0.0 112.232 -173.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -96.72 115.61 27.73 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.471 0.709 . . . . 0.0 110.739 176.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.36 -22.99 60.15 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -85.47 -40.09 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.001 -178.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.3 p -108.89 -7.14 15.51 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 60.33 13.78 4.23 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.932 2.093 . . . . 0.0 115.288 -175.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.83 153.93 42.66 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.227 1.011 . . . . 0.0 112.272 173.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.5 p -143.17 139.02 30.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.08 1.352 . . . . 0.0 111.876 179.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -154.87 154.11 32.19 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.539 0.735 . . . . 0.0 112.616 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -85.32 -39.42 17.69 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 117.743 2.497 . . . . 0.0 117.743 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -78.33 154.22 31.02 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.17 1.388 . . . . 0.0 111.312 174.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -64.96 125.73 89.71 Favored Pre-proline 0 CA--C 1.55 0.949 0 O-C-N 121.198 -0.938 . . . . 0.0 111.429 -176.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -58.6 157.68 26.5 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 124.143 3.228 . . . . 0.0 114.679 177.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 t -149.51 154.0 38.09 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.127 1.371 . . . . 0.0 111.401 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.129 0 C-N-CA 125.386 1.47 . . . . 0.0 112.729 -177.061 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.289 0 N-CA-C 116.26 1.264 . . . . 0.0 116.26 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -73.99 139.26 44.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.876 1.838 . . . . 0.0 113.909 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -151.37 156.76 41.38 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.609 1.564 . . . . 0.0 111.169 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.92 145.19 53.59 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 173.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 tpt85 -142.66 165.31 27.74 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.364 2.266 . . . . 0.0 109.613 -175.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.3 ttm -154.7 134.76 13.07 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.552 -0.718 . . . . 0.0 112.521 -175.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.1 158.55 35.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.32 1.848 . . . . 0.0 115.857 173.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.66 -22.92 65.71 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.7 p30 -80.97 -3.08 50.39 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.381 1.472 . . . . 0.0 114.566 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.96 19.93 48.87 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.745 1.164 . . . . 0.0 115.501 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.0 m -94.58 130.13 41.14 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 118.961 1.38 . . . . 0.0 111.231 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.76 143.16 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.408 1.083 . . . . 0.0 110.104 -176.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -151.25 -172.52 4.23 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.155 1.782 . . . . 0.0 108.834 175.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -123.47 141.85 51.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.323 1.449 . . . . 0.0 110.577 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -135.79 134.97 39.51 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.012 1.325 . . . . 0.0 112.566 -174.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -95.94 115.43 27.41 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.47 0.708 . . . . 0.0 110.671 176.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.46 -23.69 60.12 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.3 mt -84.61 -40.25 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.467 1.507 . . . . 0.0 111.086 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 p -109.21 -6.92 15.38 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -171.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.18 16.25 5.9 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 127.007 2.123 . . . . 0.0 113.932 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.21 154.36 41.07 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.053 -1.029 . . . . 0.0 112.059 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.2 p -143.76 138.53 28.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.889 1.276 . . . . 0.0 111.696 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -154.99 154.11 32.04 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 . . . . . 0 N--CA 1.473 0.712 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -177.231 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.298 0 N-CA-C 116.134 1.214 . . . . 0.0 116.134 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -75.22 137.5 41.29 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.75 1.775 . . . . 0.0 113.919 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -141.73 157.32 45.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.754 2.021 . . . . 0.0 111.106 174.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -68.85 145.11 54.0 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.399 -0.813 . . . . 0.0 112.783 169.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 -144.62 162.61 36.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.15 2.18 . . . . 0.0 109.59 -177.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.7 ptm -154.84 140.26 17.76 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -178.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -71.07 156.57 39.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.329 1.852 . . . . 0.0 114.986 172.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.86 -21.93 66.32 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -78.48 -3.21 42.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.098 1.359 . . . . 0.0 114.472 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.98 18.55 46.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.709 1.147 . . . . 0.0 115.416 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.64 127.37 40.55 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 118.914 1.357 . . . . 0.0 111.61 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.77 143.32 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.672 1.189 . . . . 0.0 110.371 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -150.28 -175.23 5.0 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.252 1.821 . . . . 0.0 109.172 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -120.54 143.88 48.35 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.13 1.372 . . . . 0.0 109.953 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -137.82 134.21 34.9 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.062 1.345 . . . . 0.0 112.14 -176.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -94.37 115.05 27.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.58 0.752 . . . . 0.0 110.78 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -73.64 -22.78 59.88 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -85.9 -40.17 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.427 1.491 . . . . 0.0 111.122 -178.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.6 p -109.32 -7.15 15.28 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 60.43 13.42 4.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.935 2.094 . . . . 0.0 115.306 -175.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.87 155.51 40.45 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.22 1.008 . . . . 0.0 112.272 172.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.8 p -138.35 150.06 46.21 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.044 1.338 . . . . 0.0 111.767 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -153.84 142.05 20.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.247 1.019 . . . . 0.0 110.987 -174.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 . . . . . 0 N--CA 1.474 0.729 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 172.678 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.298 0 N-CA-C 116.041 1.176 . . . . 0.0 116.041 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -76.08 136.73 39.88 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.465 1.632 . . . . 0.0 114.436 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -155.07 144.55 21.26 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.905 1.282 . . . . 0.0 111.579 169.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -58.11 145.16 37.72 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.265 1.426 . . . . 0.0 113.519 177.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.43 170.92 15.04 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 127.093 2.157 . . . . 0.0 110.788 -171.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.0 tpp -154.63 129.8 9.62 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.971 0.908 . . . . 0.0 112.153 -169.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -80.01 156.67 27.05 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 171.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.99 65.99 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -82.12 -0.29 44.06 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 125.363 1.465 . . . . 0.0 114.564 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.25 19.64 54.68 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.485 1.041 . . . . 0.0 115.274 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.7 m -94.72 132.14 39.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.747 1.219 . . . . 0.0 112.066 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -94.69 143.14 12.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 124.362 1.065 . . . . 0.0 109.228 -177.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -147.79 179.97 7.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.861 1.264 . . . . 0.0 110.378 173.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -119.48 139.29 52.32 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.537 1.935 . . . . 0.0 109.534 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -140.34 139.75 35.46 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.249 0.62 . . . . 0.0 112.296 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -100.64 115.52 30.39 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.273 1.029 . . . . 0.0 110.648 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -73.48 -22.22 60.21 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -86.55 -40.16 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 125.409 1.484 . . . . 0.0 111.134 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.8 p -109.77 -7.38 15.05 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 60.54 13.56 4.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.836 2.055 . . . . 0.0 115.391 -176.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.74 153.02 43.95 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.318 1.047 . . . . 0.0 112.157 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.7 p -142.88 149.97 39.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.753 1.221 . . . . 0.0 112.78 178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -149.18 151.66 34.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.803 1.641 . . . . 0.0 112.598 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 169.657 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 N-CA-C 115.809 1.083 . . . . 0.0 115.809 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -78.89 142.72 36.55 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.496 1.648 . . . . 0.0 113.947 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -152.23 152.09 31.78 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.534 1.934 . . . . 0.0 111.375 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -64.09 145.05 56.6 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.146 -0.971 . . . . 0.0 113.384 174.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.78 164.71 29.37 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.835 2.054 . . . . 0.0 109.968 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.2 ttp -154.74 137.06 14.9 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.528 -0.732 . . . . 0.0 112.64 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -71.54 158.09 36.84 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.186 1.794 . . . . 0.0 115.632 171.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.62 65.98 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -80.14 -3.4 48.72 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.362 1.465 . . . . 0.0 114.471 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.62 21.27 44.41 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.547 1.07 . . . . 0.0 115.382 -177.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.9 m -94.62 124.37 38.61 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.938 1.369 . . . . 0.0 111.249 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.7 t -94.69 142.78 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.274 1.029 . . . . 0.0 110.015 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -149.57 -174.35 4.66 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.117 1.767 . . . . 0.0 109.798 176.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -125.46 142.76 51.33 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.17 1.388 . . . . 0.0 109.871 -176.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.9 133.77 29.04 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.904 1.282 . . . . 0.0 112.8 -169.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -93.41 117.55 30.22 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.271 0.628 . . . . 0.0 110.842 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -74.72 -21.79 59.17 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.4 mt -85.4 -40.13 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.7 1.6 . . . . 0.0 110.987 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.9 p -110.71 -6.47 14.8 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -172.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 60.75 14.9 5.41 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.785 2.034 . . . . 0.0 115.235 -176.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.24 152.42 45.08 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.235 1.014 . . . . 0.0 112.099 172.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.2 p -141.19 147.28 38.1 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.721 1.209 . . . . 0.0 112.009 177.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -157.4 154.4 28.79 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.989 0.915 . . . . 0.0 112.465 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 118.441 2.756 . . . . 0.0 118.441 -177.998 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.372 0 N-CA-C 115.227 0.851 . . . . 0.0 115.227 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -81.04 141.72 34.08 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.958 1.379 . . . . 0.0 114.171 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.55 158.32 42.33 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.52 1.528 . . . . 0.0 111.312 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -60.81 145.16 50.88 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 171.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -145.06 162.68 36.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.024 2.129 . . . . 0.0 109.819 -177.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 56.4 ttp -154.82 135.92 13.89 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.417 -0.802 . . . . 0.0 112.649 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -72.37 159.83 33.36 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 115.867 1.802 . . . . 0.0 115.867 174.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -23.26 66.21 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -81.42 -0.5 41.79 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.213 1.405 . . . . 0.0 114.417 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.95 19.47 55.87 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.695 1.14 . . . . 0.0 115.245 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.0 m -94.65 125.59 39.4 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 118.777 1.288 . . . . 0.0 110.632 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.5 t -94.69 141.93 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.422 1.089 . . . . 0.0 109.951 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.8 p90 -150.91 -172.47 4.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.38 1.872 . . . . 0.0 108.417 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -125.78 144.87 50.45 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.57 1.148 . . . . 0.0 108.865 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -140.75 136.44 32.52 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.067 1.347 . . . . 0.0 112.26 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -93.87 115.33 27.71 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.758 0.823 . . . . 0.0 110.487 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -73.51 -21.99 60.24 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.1 mt -86.2 -40.04 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.745 1.618 . . . . 0.0 111.074 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -111.28 -7.13 14.44 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -171.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 60.84 13.75 4.68 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.746 2.018 . . . . 0.0 115.193 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.99 155.54 40.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.149 0.98 . . . . 0.0 112.057 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.7 p -141.93 148.97 39.53 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.699 1.2 . . . . 0.0 112.237 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -150.8 139.8 21.02 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.212 1.405 . . . . 0.0 112.915 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.51 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.323 0 N-CA-C 116.119 1.207 . . . . 0.0 116.119 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -74.43 137.8 42.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.645 1.722 . . . . 0.0 114.247 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -153.49 153.5 32.56 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.39 1.876 . . . . 0.0 111.104 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -66.42 145.04 56.13 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 175.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -143.1 162.99 34.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.187 2.195 . . . . 0.0 109.517 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.5 ttp -154.72 136.39 14.37 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 112.668 -175.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -71.7 157.91 37.09 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.102 1.761 . . . . 0.0 115.628 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.18 -22.34 65.82 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -80.15 -3.19 47.9 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.323 1.449 . . . . 0.0 114.427 173.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.34 21.78 43.46 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 124.595 1.093 . . . . 0.0 115.322 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -94.64 123.32 38.01 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 118.798 1.299 . . . . 0.0 111.3 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.79 142.56 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.406 1.083 . . . . 0.0 109.683 -175.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -151.05 -175.74 5.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.073 1.749 . . . . 0.0 109.545 177.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -119.65 141.57 49.22 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.654 1.582 . . . . 0.0 110.949 -177.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -139.06 135.81 34.59 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.742 1.217 . . . . 0.0 112.223 -173.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -96.59 115.25 27.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.554 0.742 . . . . 0.0 110.653 176.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.04 -22.61 60.59 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.9 mt -85.76 -40.07 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 125.454 1.502 . . . . 0.0 110.986 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.0 p -109.48 -7.32 15.19 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.175 1.916 . . . . 0.0 116.175 -171.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.52 13.49 4.21 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.936 2.094 . . . . 0.0 115.298 -175.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.21 153.33 43.85 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.187 0.995 . . . . 0.0 112.258 173.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 86.9 p -138.72 148.87 44.45 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.893 1.277 . . . . 0.0 112.052 176.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -157.61 145.91 19.15 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.674 1.19 . . . . 0.0 112.004 -175.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 N--CA 1.472 0.627 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 175.889 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.325 0 N-CA-C 116.122 1.209 . . . . 0.0 116.122 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -73.21 133.24 43.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.875 1.838 . . . . 0.0 113.836 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -144.23 161.69 38.25 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.511 1.924 . . . . 0.0 111.484 173.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -65.49 145.2 56.42 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -143.78 164.09 31.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.216 2.206 . . . . 0.0 109.585 -175.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 77.1 mtm -154.45 136.9 15.0 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -79.6 156.42 27.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.296 1.838 . . . . 0.0 115.441 172.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.34 66.44 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.2 p30 -79.91 -2.95 45.97 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.337 1.455 . . . . 0.0 114.58 174.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.29 20.9 43.4 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.548 1.071 . . . . 0.0 115.444 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.7 m -94.63 134.58 37.05 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.788 1.294 . . . . 0.0 111.63 177.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.7 t -94.71 141.55 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.996 1.318 . . . . 0.0 110.961 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.37 -172.11 4.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.494 1.517 . . . . 0.0 108.718 172.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.38 142.29 51.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.662 1.585 . . . . 0.0 110.392 -176.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.37 134.94 31.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.604 1.161 . . . . 0.0 112.525 -172.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -95.47 113.66 25.35 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.784 0.833 . . . . 0.0 110.614 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -72.53 -22.06 61.09 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.5 -40.11 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.482 1.513 . . . . 0.0 111.062 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -109.51 -6.9 15.25 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 116.177 1.918 . . . . 0.0 116.177 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.62 13.58 4.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.886 2.074 . . . . 0.0 115.276 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.57 153.63 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.158 0.983 . . . . 0.0 112.256 172.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.8 p -140.44 147.0 39.01 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.009 1.324 . . . . 0.0 112.026 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -154.13 143.61 21.52 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.839 0.856 . . . . 0.0 111.915 -175.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 175.975 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.329 0 N-CA-C 116.161 1.225 . . . . 0.0 116.161 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -73.36 139.0 45.69 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.88 1.84 . . . . 0.0 114.209 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.63 152.71 33.2 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.942 1.697 . . . . 0.0 111.42 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -63.72 145.12 56.35 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -146.08 162.18 38.49 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.577 1.951 . . . . 0.0 109.655 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.4 ptm -154.87 140.25 17.72 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.33 156.02 40.0 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.1 1.76 . . . . 0.0 114.885 172.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.06 -21.48 66.19 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -78.29 -3.47 43.08 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.187 1.395 . . . . 0.0 114.435 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.65 20.2 41.5 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 124.601 1.096 . . . . 0.0 115.199 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.2 m -94.62 125.08 39.04 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.867 1.333 . . . . 0.0 111.592 177.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.1 t -94.74 142.49 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.539 1.136 . . . . 0.0 110.348 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -149.46 -172.59 4.17 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.372 1.869 . . . . 0.0 109.359 175.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -127.54 144.16 51.1 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.476 1.511 . . . . 0.0 110.321 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -135.98 137.09 40.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.904 1.281 . . . . 0.0 111.247 -176.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -97.42 115.76 28.36 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.465 0.706 . . . . 0.0 110.85 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -72.89 -24.09 60.81 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.55 -40.23 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.479 1.512 . . . . 0.0 111.089 -178.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.8 p -110.15 -3.53 16.3 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -170.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.319 16.3 p30 53.84 15.04 0.74 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 128.271 2.628 . . . . 0.0 116.071 -174.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.27 156.22 39.11 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.62 1.168 . . . . 0.0 112.308 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.6 p -136.76 149.64 47.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.797 1.239 . . . . 0.0 111.763 173.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -155.8 145.38 21.07 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.539 1.136 . . . . 0.0 111.584 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 175.669 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.371 0 N-CA-C 115.564 0.985 . . . . 0.0 115.564 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -79.81 146.12 32.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.223 1.511 . . . . 0.0 114.107 177.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -145.6 157.99 43.9 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.158 2.183 . . . . 0.0 111.581 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -75.75 145.12 41.05 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.774 -0.579 . . . . 0.0 111.347 169.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -146.9 164.29 33.37 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.525 1.53 . . . . 0.0 110.103 -177.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.1 ttm -154.66 135.59 13.76 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.383 -0.823 . . . . 0.0 112.552 -171.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -72.25 158.13 36.42 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.39 1.876 . . . . 0.0 115.6 172.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.21 65.38 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.87 -3.33 50.91 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.424 1.49 . . . . 0.0 114.55 174.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.8 20.92 45.09 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.658 1.123 . . . . 0.0 115.443 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.57 128.55 41.27 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 118.916 1.358 . . . . 0.0 111.289 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.3 t -94.71 142.86 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.185 0.994 . . . . 0.0 110.039 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -148.66 -175.29 4.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.336 1.854 . . . . 0.0 109.274 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -125.2 143.88 50.73 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.179 1.392 . . . . 0.0 110.277 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -141.49 136.93 31.72 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.466 1.107 . . . . 0.0 110.494 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -96.24 119.1 34.13 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.536 0.735 . . . . 0.0 111.081 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -73.75 -23.52 59.76 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.0 mt -84.24 -40.23 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.852 1.661 . . . . 0.0 111.016 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -112.7 -3.01 14.34 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -170.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.327 15.8 p30 53.87 16.84 1.15 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.933 2.493 . . . . 0.0 116.046 -174.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.51 154.75 39.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.417 1.087 . . . . 0.0 111.906 171.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.2 p -144.49 146.57 32.49 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.361 1.064 . . . . 0.0 112.087 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -157.71 156.13 31.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.102 0.961 . . . . 0.0 112.3 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 118.499 2.778 . . . . 0.0 118.499 -177.939 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.296 0 N-CA-C 116.154 1.222 . . . . 0.0 116.154 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -73.56 140.12 46.07 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.918 1.859 . . . . 0.0 114.189 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -149.46 154.79 39.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.674 1.59 . . . . 0.0 110.693 174.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -64.13 145.1 56.52 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 173.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -144.18 163.64 33.02 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.16 2.184 . . . . 0.0 109.651 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 54.1 ttp -154.71 136.33 14.33 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.205 -0.934 . . . . 0.0 112.696 -176.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -72.1 158.04 36.66 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.194 1.798 . . . . 0.0 115.792 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.07 -22.94 66.18 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.4 p30 -80.09 -2.94 46.61 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.302 1.441 . . . . 0.0 114.43 173.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.52 20.61 47.42 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.745 1.164 . . . . 0.0 115.4 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 54.4 m -94.63 124.78 38.87 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 118.941 1.371 . . . . 0.0 111.043 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -94.64 141.91 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.391 1.076 . . . . 0.0 109.395 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.76 -170.32 3.62 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.201 1.8 . . . . 0.0 108.403 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -126.02 143.97 50.9 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.445 1.498 . . . . 0.0 110.163 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -135.69 134.88 39.61 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.163 1.385 . . . . 0.0 112.098 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -95.61 115.22 27.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.436 0.694 . . . . 0.0 110.69 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -73.41 -23.21 60.11 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -85.1 -40.1 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.371 1.468 . . . . 0.0 111.101 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.0 p -108.74 -7.36 15.59 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 60.26 13.64 4.08 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.005 2.122 . . . . 0.0 115.357 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.71 154.53 41.29 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.364 1.065 . . . . 0.0 112.404 173.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -132.95 148.33 52.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.166 1.387 . . . . 0.0 111.689 173.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -156.75 143.19 18.3 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.588 1.155 . . . . 0.0 112.0 -170.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.267 63.4 m-85 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 118.604 2.816 . . . . 0.0 118.604 -175.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.258 0 N-CA-C 116.262 1.265 . . . . 0.0 116.262 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -73.83 140.31 45.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.94 1.87 . . . . 0.0 114.175 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -152.27 150.46 29.8 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.403 1.881 . . . . 0.0 111.238 178.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -66.95 145.05 55.83 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.69 167.09 22.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 127.262 2.225 . . . . 0.0 110.05 -175.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.3 ttm -154.72 134.57 12.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.617 -0.677 . . . . 0.0 112.574 -174.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -71.29 158.55 36.17 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.47 1.908 . . . . 0.0 115.994 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.47 -23.04 65.6 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.3 p30 -81.3 -2.73 50.16 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.278 1.431 . . . . 0.0 114.515 174.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.74 19.75 50.27 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.731 1.158 . . . . 0.0 115.511 -178.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 59.9 m -94.7 131.07 40.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 118.995 1.397 . . . . 0.0 111.253 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.4 t -94.65 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.337 1.055 . . . . 0.0 109.986 -176.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.3 -176.17 5.27 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.949 1.7 . . . . 0.0 109.536 174.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.53 144.69 48.57 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.703 1.601 . . . . 0.0 110.237 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -139.36 135.72 34.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.898 1.279 . . . . 0.0 111.968 -175.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -97.02 116.77 29.81 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.283 0.633 . . . . 0.0 110.799 175.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -74.01 -22.95 59.39 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -176.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.9 mt -85.06 -40.17 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.502 1.521 . . . . 0.0 110.989 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.0 p -110.18 -6.12 15.15 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -171.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 60.17 14.76 4.74 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.796 2.038 . . . . 0.0 115.267 -175.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.56 152.27 45.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.211 1.004 . . . . 0.0 112.183 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.0 p -140.24 142.26 35.82 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.981 1.312 . . . . 0.0 111.914 177.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -155.08 146.39 22.91 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.181 0.993 . . . . 0.0 111.915 -174.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 176.772 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.255 0 N-CA-C 115.653 1.021 . . . . 0.0 115.653 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -76.9 140.96 40.71 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 119.461 1.631 . . . . 0.0 113.785 178.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -153.48 154.38 34.27 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.945 1.698 . . . . 0.0 111.438 176.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -57.01 145.36 30.69 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -146.93 164.34 33.25 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.685 1.994 . . . . 0.0 110.5 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 53.1 ttp -154.79 135.84 13.86 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.61 -0.681 . . . . 0.0 112.615 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -71.05 158.15 36.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.192 1.797 . . . . 0.0 115.65 172.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.98 65.99 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.2 p30 -80.36 -3.08 48.18 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.349 1.46 . . . . 0.0 114.455 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.01 20.07 48.09 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.737 1.16 . . . . 0.0 115.416 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 56.1 m -94.68 126.11 39.77 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 119.026 1.413 . . . . 0.0 111.16 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.5 t -94.68 142.26 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.279 1.031 . . . . 0.0 109.85 -174.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -150.34 -173.05 4.33 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.192 1.797 . . . . 0.0 109.032 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -128.16 141.73 51.39 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.38 1.472 . . . . 0.0 109.034 -175.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -137.98 134.16 34.55 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.831 1.253 . . . . 0.0 112.126 -170.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -92.97 114.73 27.37 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 110.678 177.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.03 -22.67 60.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.7 mt -85.13 -40.18 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 111.056 -177.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 p -111.76 -6.81 14.27 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -171.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 60.76 14.13 4.87 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.766 2.026 . . . . 0.0 115.193 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.95 155.57 39.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.088 0.955 . . . . 0.0 112.217 172.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 70.8 p -141.91 145.32 34.43 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.868 1.267 . . . . 0.0 111.993 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -152.14 142.72 22.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.297 1.039 . . . . 0.0 111.703 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 117.167 2.284 . . . . 0.0 117.167 176.485 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.395 0 N-CA-C 116.15 1.22 . . . . 0.0 116.15 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -73.66 135.79 43.78 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.943 1.872 . . . . 0.0 113.832 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -145.66 163.75 33.89 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.904 1.682 . . . . 0.0 112.243 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.43 145.12 56.59 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 172.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -143.5 161.67 37.83 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.213 2.205 . . . . 0.0 109.769 -176.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.7 ttt -154.77 131.37 10.6 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -171.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -77.69 155.09 31.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.589 1.955 . . . . 0.0 115.514 175.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -22.36 66.82 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -79.94 -0.79 36.58 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.61 13.14 56.02 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 124.701 1.144 . . . . 0.0 115.418 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 30.9 m -94.68 127.56 40.75 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.863 1.331 . . . . 0.0 112.343 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.79 142.98 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.475 1.11 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -149.62 -169.02 3.27 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.328 1.851 . . . . 0.0 108.83 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -127.46 145.37 50.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.573 1.549 . . . . 0.0 110.429 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -141.2 134.63 29.79 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.107 1.363 . . . . 0.0 112.241 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -94.73 115.78 27.94 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.726 176.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.71 -22.42 59.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.6 mt -85.68 -40.13 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.508 1.523 . . . . 0.0 111.08 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -110.49 -6.02 15.01 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -171.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.35 14.66 4.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.819 2.047 . . . . 0.0 115.302 -176.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.75 152.51 45.23 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.146 0.979 . . . . 0.0 112.161 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 56.6 p -139.8 144.24 37.26 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.99 1.316 . . . . 0.0 111.986 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -156.79 143.76 18.66 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.455 1.102 . . . . 0.0 111.049 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.253 43.3 t80 . . . . . 0 N--CA 1.47 0.543 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 177.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.344 0 N-CA-C 116.075 1.19 . . . . 0.0 116.075 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -73.72 138.23 44.51 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.72 1.76 . . . . 0.0 113.943 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.72 154.7 36.82 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.157 1.783 . . . . 0.0 111.205 175.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -62.55 145.02 55.39 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -144.11 163.54 33.28 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.169 2.188 . . . . 0.0 109.74 -176.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.1 ttm -154.71 135.06 13.28 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.412 -0.805 . . . . 0.0 112.521 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -71.25 158.14 36.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.271 1.828 . . . . 0.0 115.81 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -22.57 65.42 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.83 -3.32 50.72 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.396 1.478 . . . . 0.0 114.505 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.83 21.03 44.5 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 124.721 1.153 . . . . 0.0 115.448 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.2 m -94.61 127.03 40.29 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.999 1.4 . . . . 0.0 111.237 178.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.6 t -94.65 142.96 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.431 1.092 . . . . 0.0 110.359 -176.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -151.39 -175.61 5.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.114 1.765 . . . . 0.0 109.199 175.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -118.93 142.67 47.56 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.955 1.302 . . . . 0.0 110.351 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -135.94 134.59 38.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.243 1.417 . . . . 0.0 112.706 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -96.31 114.62 26.32 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.432 0.693 . . . . 0.0 110.77 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -73.41 -22.84 60.13 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.6 mt -85.14 -40.16 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.357 1.463 . . . . 0.0 111.048 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 p -108.62 -7.04 15.76 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -172.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.41 13.29 3.98 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.922 2.089 . . . . 0.0 115.313 -175.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.66 152.63 45.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.055 0.942 . . . . 0.0 112.116 173.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.1 p -138.8 145.46 40.14 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.6 1.16 . . . . 0.0 111.482 174.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -157.05 143.81 18.4 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.092 0.957 . . . . 0.0 112.286 -174.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 176.321 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 N-CA-C 116.239 1.256 . . . . 0.0 116.239 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -73.17 139.08 46.09 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.807 1.804 . . . . 0.0 114.088 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.79 152.09 33.29 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.807 1.643 . . . . 0.0 111.434 174.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -59.75 145.41 45.27 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 175.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -146.5 163.08 36.86 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.56 1.944 . . . . 0.0 110.592 -178.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.6 ptp -154.91 140.1 17.54 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -178.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.0 156.76 37.2 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.584 1.953 . . . . 0.0 115.221 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -22.03 66.27 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.7 p30 -79.0 -3.18 43.79 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.23 1.412 . . . . 0.0 114.593 174.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.24 19.16 47.11 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.675 1.131 . . . . 0.0 115.469 -178.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.5 m -94.59 129.75 41.3 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 118.834 1.317 . . . . 0.0 111.613 177.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.73 142.96 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.566 1.147 . . . . 0.0 110.299 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -149.18 -171.76 3.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.307 1.843 . . . . 0.0 108.81 174.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -128.49 143.9 51.05 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.449 1.5 . . . . 0.0 109.885 -177.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -134.15 134.56 42.3 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.21 1.404 . . . . 0.0 112.251 -176.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -96.13 115.0 26.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.476 0.71 . . . . 0.0 110.821 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.48 -22.99 60.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -85.33 -40.09 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.3 1.44 . . . . 0.0 111.053 -178.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.72 -6.85 15.74 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 60.23 13.73 4.11 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.991 2.116 . . . . 0.0 115.296 -175.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.85 153.08 43.78 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.248 1.019 . . . . 0.0 112.343 173.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.9 p -137.04 141.19 42.46 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.15 1.38 . . . . 0.0 111.496 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -153.39 144.02 22.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.158 0.983 . . . . 0.0 112.28 -172.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 178.468 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.392 0 N-CA-C 116.198 1.239 . . . . 0.0 116.198 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.0 m95 -85.22 144.54 28.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 118.706 1.253 . . . . 0.0 113.407 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.25 150.5 33.81 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.835 1.654 . . . . 0.0 111.23 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -65.82 145.04 56.44 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 176.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -144.75 165.83 26.96 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.233 2.213 . . . . 0.0 109.571 -175.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -154.79 135.86 13.86 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.291 -0.881 . . . . 0.0 112.511 -173.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -70.37 158.07 36.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.282 1.833 . . . . 0.0 115.629 172.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.48 -22.88 65.48 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -81.31 -3.32 52.22 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.415 1.486 . . . . 0.0 114.632 174.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.95 19.59 46.57 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.631 1.11 . . . . 0.0 115.614 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.3 m -94.6 128.43 41.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 118.969 1.384 . . . . 0.0 111.349 178.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.57 143.86 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.359 1.064 . . . . 0.0 110.213 -174.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -150.71 -172.97 4.33 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.968 1.707 . . . . 0.0 109.759 175.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -124.67 143.7 50.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.064 1.746 . . . . 0.0 110.007 -175.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -140.76 132.7 27.66 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.838 1.255 . . . . 0.0 111.568 -170.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -91.46 120.71 32.52 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.371 0.669 . . . . 0.0 110.685 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -77.13 -20.16 55.96 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -172.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.8 mp -86.06 -40.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.818 1.247 . . . . 0.0 111.741 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 p -108.95 -7.31 15.43 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -170.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.1 m-80 59.91 16.11 5.48 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.521 1.928 . . . . 0.0 114.814 -175.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.54 152.93 44.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.955 0.902 . . . . 0.0 111.837 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.7 p -136.72 148.24 47.2 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.621 1.169 . . . . 0.0 112.265 178.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.2 tp60 -156.25 142.42 18.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.357 1.463 . . . . 0.0 111.348 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.345 53.1 t80 . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 118.815 2.894 . . . . 0.0 118.815 -171.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.372 0 N-CA-C 116.148 1.219 . . . . 0.0 116.148 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -74.85 139.3 43.1 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.767 1.784 . . . . 0.0 114.048 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.85 154.1 36.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.994 1.718 . . . . 0.0 111.108 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -61.97 145.14 53.85 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 175.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpt85 -142.82 163.05 33.85 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.281 2.232 . . . . 0.0 109.468 -175.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 50.8 ttp -154.78 136.1 14.07 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.348 -0.845 . . . . 0.0 112.853 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -70.49 157.72 37.35 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.161 1.784 . . . . 0.0 115.365 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.02 -22.42 65.7 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.6 -3.51 50.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.437 1.495 . . . . 0.0 114.631 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.75 43.71 Favored Glycine 0 CA--C 1.539 1.538 0 C-N-CA 124.6 1.095 . . . . 0.0 115.397 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.1 m -94.59 124.62 38.73 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.948 1.374 . . . . 0.0 111.482 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.4 t -94.75 142.81 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.346 1.059 . . . . 0.0 110.067 -173.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -149.47 -171.86 3.99 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.373 1.869 . . . . 0.0 109.639 176.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -123.59 142.42 51.05 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.668 1.587 . . . . 0.0 109.93 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -136.87 135.22 37.68 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.933 1.293 . . . . 0.0 112.652 -176.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -96.17 114.89 26.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.55 0.74 . . . . 0.0 110.757 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -73.82 -23.63 59.69 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.8 mt -84.8 -40.08 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.336 1.454 . . . . 0.0 111.07 -178.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.93 -7.47 15.42 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.18 1.918 . . . . 0.0 116.18 -171.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.27 15.37 5.29 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.802 2.041 . . . . 0.0 113.923 -175.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.67 155.64 40.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.052 -1.03 . . . . 0.0 112.08 172.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.1 p -141.18 150.03 42.23 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.641 1.176 . . . . 0.0 111.938 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -155.0 139.78 17.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.622 1.169 . . . . 0.0 111.3 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 48.8 t80 . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 169.738 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.34 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -73.76 134.94 43.53 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 120.002 1.901 . . . . 0.0 114.109 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -145.51 162.04 38.33 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.85 2.06 . . . . 0.0 111.444 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -69.8 145.09 52.42 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.442 -0.786 . . . . 0.0 112.994 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -143.24 165.2 28.12 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.291 2.236 . . . . 0.0 109.835 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.2 ttm -154.63 134.25 12.78 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.362 -0.836 . . . . 0.0 112.512 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -71.26 158.58 36.14 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.334 1.853 . . . . 0.0 115.438 172.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.89 -22.44 65.56 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -81.0 -3.66 52.47 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.439 1.496 . . . . 0.0 114.625 174.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.04 22.24 39.19 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.538 1.066 . . . . 0.0 115.331 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.9 m -94.59 126.95 40.21 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.902 1.351 . . . . 0.0 111.116 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.7 t -94.69 142.67 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.195 0.998 . . . . 0.0 109.954 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -151.83 -174.29 4.81 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.947 1.699 . . . . 0.0 108.801 176.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -120.51 143.65 48.44 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.47 1.508 . . . . 0.0 110.637 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -142.66 136.11 28.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.598 1.159 . . . . 0.0 111.561 -172.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -94.77 117.0 29.42 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.252 0.621 . . . . 0.0 110.814 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -72.69 -22.98 60.82 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.3 mt -86.09 -40.08 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.708 1.603 . . . . 0.0 111.102 -177.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -112.12 -3.55 14.67 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.272 1.953 . . . . 0.0 116.272 -170.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.331 15.7 p30 53.69 17.36 1.21 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.89 2.476 . . . . 0.0 115.979 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.2 152.68 44.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.338 1.055 . . . . 0.0 111.931 170.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.6 p -141.02 148.65 40.62 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.8 1.24 . . . . 0.0 112.154 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -158.64 146.27 17.94 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.585 1.154 . . . . 0.0 111.804 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 177.386 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.294 0 N-CA-C 115.795 1.078 . . . . 0.0 115.795 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -75.1 138.97 42.46 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.637 1.718 . . . . 0.0 113.771 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -147.37 165.52 29.94 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.685 1.994 . . . . 0.0 112.054 176.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -65.68 145.19 56.33 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -144.24 162.3 36.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.983 2.113 . . . . 0.0 110.082 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.3 ttp -154.73 137.24 15.07 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.439 -0.788 . . . . 0.0 112.811 -177.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -71.09 157.99 37.24 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.179 1.792 . . . . 0.0 115.461 172.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -23.09 65.88 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 p30 -81.02 -3.19 50.92 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.349 1.46 . . . . 0.0 114.537 174.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.43 19.99 46.87 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.61 1.1 . . . . 0.0 115.5 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.9 m -94.62 126.14 39.72 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.952 1.376 . . . . 0.0 111.344 177.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.0 t -94.65 142.12 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.255 1.022 . . . . 0.0 110.175 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -148.43 -168.73 3.17 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.55 1.94 . . . . 0.0 108.83 174.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -130.32 147.11 51.99 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.512 1.125 . . . . 0.0 109.591 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -142.48 134.59 27.38 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.56 1.544 . . . . 0.0 112.473 -169.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -92.96 116.17 28.8 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.331 0.653 . . . . 0.0 110.875 175.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -73.77 -22.01 59.99 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -176.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.6 mt -86.31 -40.19 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.668 1.587 . . . . 0.0 111.133 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 p -110.39 -6.26 15.01 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -171.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 60.52 14.82 5.12 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.783 2.033 . . . . 0.0 115.239 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.0 152.49 45.19 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.244 1.018 . . . . 0.0 111.984 172.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.1 p -140.38 143.73 35.85 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.925 1.29 . . . . 0.0 112.139 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -155.84 141.72 18.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.418 1.087 . . . . 0.0 111.145 -177.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.254 43.3 t80 . . . . . 0 CA--C 1.538 0.502 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 177.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.305 0 N-CA-C 116.228 1.251 . . . . 0.0 116.228 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -74.09 139.91 44.94 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.866 1.833 . . . . 0.0 114.028 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.04 155.72 38.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.055 1.742 . . . . 0.0 110.606 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.49 145.07 56.58 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.096 -1.002 . . . . 0.0 113.335 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -144.53 162.36 36.78 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.058 2.143 . . . . 0.0 109.648 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.8 ptp -154.82 140.11 17.64 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -72.77 159.12 34.3 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.302 1.841 . . . . 0.0 115.347 174.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.39 -22.77 66.4 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 178.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 p30 -80.27 -0.71 37.66 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.156 1.383 . . . . 0.0 114.491 173.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.12 18.76 55.17 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.664 1.126 . . . . 0.0 115.371 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.9 m -94.73 128.3 41.33 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.678 1.239 . . . . 0.0 110.974 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.3 t -94.7 143.2 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.644 1.178 . . . . 0.0 110.429 -176.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -150.49 -173.57 4.5 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.27 1.828 . . . . 0.0 109.036 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -122.54 141.89 51.2 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.172 1.389 . . . . 0.0 110.547 -178.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -136.6 135.5 38.42 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.942 1.297 . . . . 0.0 112.232 -173.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -96.72 115.61 27.73 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.471 0.709 . . . . 0.0 110.739 176.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.36 -22.99 60.15 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -85.47 -40.09 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.001 -178.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.3 p -108.89 -7.14 15.51 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 60.33 13.78 4.23 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.932 2.093 . . . . 0.0 115.288 -175.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.83 153.93 42.66 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.227 1.011 . . . . 0.0 112.272 173.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.5 p -143.17 139.02 30.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.08 1.352 . . . . 0.0 111.876 179.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -154.87 154.11 32.19 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.539 0.735 . . . . 0.0 112.616 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 117.743 2.497 . . . . 0.0 117.743 -178.238 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 119.307 -0.378 . . . . 0.0 111.064 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 19.4 mt -148.15 164.26 22.96 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 126.797 2.039 . . . . 0.0 110.626 -174.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -66.08 168.28 16.05 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 123.66 2.907 . . . . 0.0 112.851 174.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.32 123.23 12.24 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.817 3.011 . . . . 0.0 114.51 -174.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.64 -17.26 21.32 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.666 1.603 . . . . 0.0 116.26 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -73.99 139.26 44.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.876 1.838 . . . . 0.0 113.909 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -151.37 156.76 41.38 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.609 1.564 . . . . 0.0 111.169 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.92 145.19 53.59 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 173.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 tpt85 -142.66 165.31 27.74 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.364 2.266 . . . . 0.0 109.613 -175.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.3 ttm -154.7 134.76 13.07 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.552 -0.718 . . . . 0.0 112.521 -175.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.1 158.55 35.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.32 1.848 . . . . 0.0 115.857 173.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.66 -22.92 65.71 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.7 p30 -80.97 -3.08 50.39 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.381 1.472 . . . . 0.0 114.566 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.96 19.93 48.87 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.745 1.164 . . . . 0.0 115.501 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.0 m -94.58 130.13 41.14 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 118.961 1.38 . . . . 0.0 111.231 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.8 t -94.76 143.16 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.408 1.083 . . . . 0.0 110.104 -176.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -151.25 -172.52 4.23 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.155 1.782 . . . . 0.0 108.834 175.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -123.47 141.85 51.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 125.323 1.449 . . . . 0.0 110.577 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -135.79 134.97 39.51 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.012 1.325 . . . . 0.0 112.566 -174.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -95.94 115.43 27.41 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.47 0.708 . . . . 0.0 110.671 176.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.46 -23.69 60.12 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.3 mt -84.61 -40.25 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.467 1.507 . . . . 0.0 111.086 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 p -109.21 -6.92 15.38 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 -171.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.18 16.25 5.9 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 127.007 2.123 . . . . 0.0 113.932 -176.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.21 154.36 41.07 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.053 -1.029 . . . . 0.0 112.059 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.2 p -143.76 138.53 28.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.889 1.276 . . . . 0.0 111.696 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -154.99 154.11 32.04 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -85.63 -37.03 19.95 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -177.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 87.6 tt0 -82.75 149.35 27.31 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.723 1.209 . . . . 0.0 110.898 174.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.0 ttp180 -60.29 125.66 82.23 Favored Pre-proline 0 CA--C 1.548 0.902 0 O-C-N 121.2 -0.938 . . . . 0.0 111.813 -176.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -57.92 153.78 42.38 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 124.27 3.313 . . . . 0.0 113.307 176.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.2 m -146.93 153.97 40.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.036 1.334 . . . . 0.0 112.073 -175.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.222 0 C-N-CA 125.141 1.353 . . . . 0.0 112.946 -178.348 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 111.47 0.174 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.2 mt -135.22 163.03 53.92 Favored Pre-proline 0 CA--C 1.551 1.0 0 C-N-CA 126.508 1.923 . . . . 0.0 110.891 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -67.14 170.47 13.11 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.25 2.633 . . . . 0.0 113.015 177.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -52.6 123.5 13.02 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.595 2.863 . . . . 0.0 114.37 -175.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.19 -15.71 21.04 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 125.632 1.587 . . . . 0.0 116.134 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -75.22 137.5 41.29 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.75 1.775 . . . . 0.0 113.919 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -141.73 157.32 45.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.754 2.021 . . . . 0.0 111.106 174.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -68.85 145.11 54.0 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.399 -0.813 . . . . 0.0 112.783 169.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 -144.62 162.61 36.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.15 2.18 . . . . 0.0 109.59 -177.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.7 ptm -154.84 140.26 17.76 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 -178.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -71.07 156.57 39.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.329 1.852 . . . . 0.0 114.986 172.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.86 -21.93 66.32 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 p30 -78.48 -3.21 42.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.098 1.359 . . . . 0.0 114.472 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.98 18.55 46.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.709 1.147 . . . . 0.0 115.416 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.64 127.37 40.55 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 118.914 1.357 . . . . 0.0 111.61 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.77 143.32 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.672 1.189 . . . . 0.0 110.371 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -150.28 -175.23 5.0 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.252 1.821 . . . . 0.0 109.172 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -120.54 143.88 48.35 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.13 1.372 . . . . 0.0 109.953 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -137.82 134.21 34.9 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.062 1.345 . . . . 0.0 112.14 -176.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -94.37 115.05 27.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.58 0.752 . . . . 0.0 110.78 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -73.64 -22.78 59.88 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -85.9 -40.17 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.427 1.491 . . . . 0.0 111.122 -178.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.6 p -109.32 -7.15 15.28 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 60.43 13.42 4.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.935 2.094 . . . . 0.0 115.306 -175.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.87 155.51 40.45 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.22 1.008 . . . . 0.0 112.272 172.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.8 p -138.35 150.06 46.21 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.044 1.338 . . . . 0.0 111.767 175.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -153.84 142.05 20.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.247 1.019 . . . . 0.0 110.987 -174.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -84.51 -41.1 16.87 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 172.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.1 mp0 -73.4 157.78 36.25 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.064 1.746 . . . . 0.0 111.075 169.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -59.12 118.63 31.5 Favored Pre-proline 0 N--CA 1.476 0.84 0 CA-C-O 118.342 -0.837 . . . . 0.0 108.919 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.61 144.3 97.47 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.121 2.547 . . . . 0.0 112.166 -174.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.6 m 50.74 57.82 6.21 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.83 1.252 . . . . 0.0 112.674 -171.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.242 0 C-N-CA 125.453 1.501 . . . . 0.0 113.707 -179.341 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 77.6 tttt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 119.868 -0.11 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 49.4 mt -133.63 162.06 59.94 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 126.159 1.784 . . . . 0.0 111.495 -175.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.06 171.87 12.94 Favored 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 123.922 3.081 . . . . 0.0 113.108 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -53.13 129.15 32.02 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.61 2.873 . . . . 0.0 114.179 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.48 -19.82 6.72 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 125.536 1.541 . . . . 0.0 116.041 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -76.08 136.73 39.88 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.465 1.632 . . . . 0.0 114.436 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -155.07 144.55 21.26 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.905 1.282 . . . . 0.0 111.579 169.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -58.11 145.16 37.72 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.265 1.426 . . . . 0.0 113.519 177.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.43 170.92 15.04 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 127.093 2.157 . . . . 0.0 110.788 -171.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.0 tpp -154.63 129.8 9.62 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.971 0.908 . . . . 0.0 112.153 -169.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -80.01 156.67 27.05 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 171.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.99 65.99 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -82.12 -0.29 44.06 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 125.363 1.465 . . . . 0.0 114.564 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 87.25 19.64 54.68 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.485 1.041 . . . . 0.0 115.274 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.7 m -94.72 132.14 39.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.747 1.219 . . . . 0.0 112.066 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -94.69 143.14 12.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 124.362 1.065 . . . . 0.0 109.228 -177.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -147.79 179.97 7.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.861 1.264 . . . . 0.0 110.378 173.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -119.48 139.29 52.32 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.537 1.935 . . . . 0.0 109.534 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -140.34 139.75 35.46 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.249 0.62 . . . . 0.0 112.296 -178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -100.64 115.52 30.39 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.273 1.029 . . . . 0.0 110.648 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -73.48 -22.22 60.21 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -86.55 -40.16 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 125.409 1.484 . . . . 0.0 111.134 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.8 p -109.77 -7.38 15.05 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 60.54 13.56 4.27 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.836 2.055 . . . . 0.0 115.391 -176.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.74 153.02 43.95 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.318 1.047 . . . . 0.0 112.157 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.7 p -142.88 149.97 39.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.753 1.221 . . . . 0.0 112.78 178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -149.18 151.66 34.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.803 1.641 . . . . 0.0 112.598 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -84.86 -21.82 29.65 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 116.227 1.936 . . . . 0.0 116.227 169.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -110.07 155.85 21.32 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.533 1.533 . . . . 0.0 110.942 169.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -63.57 148.23 94.32 Favored Pre-proline 0 N--CA 1.474 0.743 0 O-C-N 121.396 -0.815 . . . . 0.0 112.735 -175.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -67.82 150.86 78.89 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.49 2.793 . . . . 0.0 112.195 174.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.6 p -71.01 157.13 38.75 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.393 1.077 . . . . 0.0 113.127 175.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.156 0 C-N-CA 125.131 1.348 . . . . 0.0 112.81 -179.053 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.7 tttt . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 119.436 -0.316 . . . . 0.0 110.928 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.8 mp -71.23 154.39 93.84 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 124.729 1.212 . . . . 0.0 110.844 169.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -68.6 165.85 27.92 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.77 2.98 . . . . 0.0 112.614 173.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -53.94 135.66 64.12 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.762 2.974 . . . . 0.0 114.673 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.69 -22.39 4.09 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.57 1.557 . . . . 0.0 115.809 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -78.89 142.72 36.55 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.496 1.648 . . . . 0.0 113.947 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -152.23 152.09 31.78 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.534 1.934 . . . . 0.0 111.375 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -64.09 145.05 56.6 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.146 -0.971 . . . . 0.0 113.384 174.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.78 164.71 29.37 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.835 2.054 . . . . 0.0 109.968 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.2 ttp -154.74 137.06 14.9 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.528 -0.732 . . . . 0.0 112.64 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -71.54 158.09 36.84 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.186 1.794 . . . . 0.0 115.632 171.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.12 -22.62 65.98 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.0 p30 -80.14 -3.4 48.72 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.362 1.465 . . . . 0.0 114.471 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.62 21.27 44.41 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.547 1.07 . . . . 0.0 115.382 -177.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.9 m -94.62 124.37 38.61 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.938 1.369 . . . . 0.0 111.249 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.7 t -94.69 142.78 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.274 1.029 . . . . 0.0 110.015 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -149.57 -174.35 4.66 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.117 1.767 . . . . 0.0 109.798 176.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -125.46 142.76 51.33 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.17 1.388 . . . . 0.0 109.871 -176.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.9 133.77 29.04 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.904 1.282 . . . . 0.0 112.8 -169.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -93.41 117.55 30.22 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.271 0.628 . . . . 0.0 110.842 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -74.72 -21.79 59.17 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.4 mt -85.4 -40.13 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.7 1.6 . . . . 0.0 110.987 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.9 p -110.71 -6.47 14.8 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -172.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 60.75 14.9 5.41 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.785 2.034 . . . . 0.0 115.235 -176.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.24 152.42 45.08 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.235 1.014 . . . . 0.0 112.099 172.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.2 p -141.19 147.28 38.1 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.721 1.209 . . . . 0.0 112.009 177.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -157.4 154.4 28.79 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.989 0.915 . . . . 0.0 112.465 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -84.29 -30.83 25.27 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 118.441 2.756 . . . . 0.0 118.441 -177.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -90.1 153.87 20.22 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.872 1.269 . . . . 0.0 111.983 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.1 122.96 80.53 Favored Pre-proline 0 N--CA 1.478 0.963 0 O-C-N 121.323 -0.861 . . . . 0.0 110.914 -176.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.17 155.44 67.87 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.149 2.566 . . . . 0.0 112.388 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 22.6 t -151.64 153.02 33.64 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.072 1.349 . . . . 0.0 111.512 178.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.135 0 C-N-CA 125.521 1.534 . . . . 0.0 112.912 -176.634 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.1 tptm . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 120.561 0.22 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.73 156.53 12.23 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 126.081 1.753 . . . . 0.0 112.773 174.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -66.64 166.25 22.72 Favored 'Trans proline' 0 CA--C 1.549 1.244 0 C-N-CA 123.816 3.011 . . . . 0.0 112.828 177.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -53.26 139.62 63.28 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.646 2.897 . . . . 0.0 114.323 -178.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.9 -29.47 2.1 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.527 1.537 . . . . 0.0 115.227 -176.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -81.04 141.72 34.08 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.958 1.379 . . . . 0.0 114.171 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.55 158.32 42.33 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.52 1.528 . . . . 0.0 111.312 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -60.81 145.16 50.88 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 171.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -145.06 162.68 36.37 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.024 2.129 . . . . 0.0 109.819 -177.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 56.4 ttp -154.82 135.92 13.89 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.417 -0.802 . . . . 0.0 112.649 -177.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -72.37 159.83 33.36 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 115.867 1.802 . . . . 0.0 115.867 174.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -23.26 66.21 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -81.42 -0.5 41.79 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.213 1.405 . . . . 0.0 114.417 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.95 19.47 55.87 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.695 1.14 . . . . 0.0 115.245 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.0 m -94.65 125.59 39.4 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 118.777 1.288 . . . . 0.0 110.632 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.5 t -94.69 141.93 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.422 1.089 . . . . 0.0 109.951 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.8 p90 -150.91 -172.47 4.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.38 1.872 . . . . 0.0 108.417 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -125.78 144.87 50.45 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.57 1.148 . . . . 0.0 108.865 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -140.75 136.44 32.52 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.067 1.347 . . . . 0.0 112.26 -169.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -93.87 115.33 27.71 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.758 0.823 . . . . 0.0 110.487 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -73.51 -21.99 60.24 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.1 mt -86.2 -40.04 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 125.745 1.618 . . . . 0.0 111.074 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -111.28 -7.13 14.44 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -171.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 60.84 13.75 4.68 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.746 2.018 . . . . 0.0 115.193 -175.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.99 155.54 40.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.149 0.98 . . . . 0.0 112.057 171.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.7 p -141.93 148.97 39.53 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.699 1.2 . . . . 0.0 112.237 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -150.8 139.8 21.02 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.212 1.405 . . . . 0.0 112.915 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -80.15 -28.46 38.84 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -86.43 148.7 25.44 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.668 1.587 . . . . 0.0 111.73 172.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.3 mmm-85 -57.38 120.88 43.69 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 124.528 1.131 . . . . 0.0 111.406 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.08 151.47 67.28 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.716 2.277 . . . . 0.0 111.25 171.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.4 p -148.67 160.72 42.89 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.089 1.356 . . . . 0.0 112.41 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.157 0 C-N-CA 125.237 1.399 . . . . 0.0 113.071 -179.408 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 83.4 tttt . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 119.305 -0.378 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 42.9 mt -150.02 164.41 20.8 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 126.772 2.029 . . . . 0.0 110.75 -172.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -67.64 169.45 15.88 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 123.76 2.973 . . . . 0.0 112.947 174.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -53.5 129.28 33.0 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.561 2.841 . . . . 0.0 113.987 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.52 -18.73 10.36 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.538 1.542 . . . . 0.0 116.119 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -74.43 137.8 42.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.645 1.722 . . . . 0.0 114.247 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -153.49 153.5 32.56 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.39 1.876 . . . . 0.0 111.104 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -66.42 145.04 56.13 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 175.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -143.1 162.99 34.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.187 2.195 . . . . 0.0 109.517 -176.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.5 ttp -154.72 136.39 14.37 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 112.668 -175.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -71.7 157.91 37.09 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.102 1.761 . . . . 0.0 115.628 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.18 -22.34 65.82 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -80.15 -3.19 47.9 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.323 1.449 . . . . 0.0 114.427 173.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.34 21.78 43.46 Favored Glycine 0 CA--C 1.538 1.5 0 C-N-CA 124.595 1.093 . . . . 0.0 115.322 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -94.64 123.32 38.01 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 118.798 1.299 . . . . 0.0 111.3 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.7 t -94.79 142.56 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.406 1.083 . . . . 0.0 109.683 -175.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.3 p90 -151.05 -175.74 5.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.073 1.749 . . . . 0.0 109.545 177.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -119.65 141.57 49.22 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.654 1.582 . . . . 0.0 110.949 -177.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -139.06 135.81 34.59 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.742 1.217 . . . . 0.0 112.223 -173.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -96.59 115.25 27.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.554 0.742 . . . . 0.0 110.653 176.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.04 -22.61 60.59 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.9 mt -85.76 -40.07 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 125.454 1.502 . . . . 0.0 110.986 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.0 p -109.48 -7.32 15.19 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.175 1.916 . . . . 0.0 116.175 -171.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.52 13.49 4.21 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.936 2.094 . . . . 0.0 115.298 -175.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.21 153.33 43.85 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.187 0.995 . . . . 0.0 112.258 173.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 86.9 p -138.72 148.87 44.45 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.893 1.277 . . . . 0.0 112.052 176.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -157.61 145.91 19.15 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.674 1.19 . . . . 0.0 112.004 -175.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -89.72 -44.48 9.98 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -75.1 122.87 24.23 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.102 0.961 . . . . 0.0 110.302 174.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -58.74 136.15 86.71 Favored Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -169.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -62.69 154.92 62.28 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.319 2.679 . . . . 0.0 112.38 171.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.9 t -70.58 137.47 50.07 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.458 -0.776 . . . . 0.0 111.903 176.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.276 0 CA-C-O 117.163 -1.91 . . . . 0.0 114.69 179.414 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 119.611 -0.233 . . . . 0.0 111.503 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 46.5 mt -134.85 162.72 56.02 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.719 2.008 . . . . 0.0 111.132 -178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -66.97 168.97 15.85 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 123.729 2.952 . . . . 0.0 112.955 175.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -52.41 126.84 21.9 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.565 2.844 . . . . 0.0 113.948 -178.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.36 -21.58 7.09 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 125.591 1.567 . . . . 0.0 116.122 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -73.21 133.24 43.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.875 1.838 . . . . 0.0 113.836 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -144.23 161.69 38.25 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.511 1.924 . . . . 0.0 111.484 173.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -65.49 145.2 56.42 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 169.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -143.78 164.09 31.49 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.216 2.206 . . . . 0.0 109.585 -175.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 77.1 mtm -154.45 136.9 15.0 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -170.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -79.6 156.42 27.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.296 1.838 . . . . 0.0 115.441 172.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.71 -22.34 66.44 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.2 p30 -79.91 -2.95 45.97 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.337 1.455 . . . . 0.0 114.58 174.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.29 20.9 43.4 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.548 1.071 . . . . 0.0 115.444 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.7 m -94.63 134.58 37.05 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.788 1.294 . . . . 0.0 111.63 177.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.7 t -94.71 141.55 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.996 1.318 . . . . 0.0 110.961 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.37 -172.11 4.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.494 1.517 . . . . 0.0 108.718 172.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -125.38 142.29 51.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.662 1.585 . . . . 0.0 110.392 -176.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -140.37 134.94 31.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.604 1.161 . . . . 0.0 112.525 -172.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -95.47 113.66 25.35 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.784 0.833 . . . . 0.0 110.614 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -72.53 -22.06 61.09 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.5 -40.11 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.482 1.513 . . . . 0.0 111.062 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 p -109.51 -6.9 15.25 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 116.177 1.918 . . . . 0.0 116.177 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.62 13.58 4.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.886 2.074 . . . . 0.0 115.276 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.57 153.63 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.158 0.983 . . . . 0.0 112.256 172.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.8 p -140.44 147.0 39.01 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.009 1.324 . . . . 0.0 112.026 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -154.13 143.61 21.52 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.839 0.856 . . . . 0.0 111.915 -175.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -83.56 -38.7 21.33 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 175.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -79.81 152.3 29.81 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.294 0.638 . . . . 0.0 109.815 169.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -70.12 137.48 87.01 Favored Pre-proline 0 CA--C 1.542 0.642 0 O-C-N 121.574 -0.704 . . . . 0.0 111.903 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -60.05 148.22 90.02 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.483 2.788 . . . . 0.0 111.847 169.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 77.7 p 48.45 38.03 10.05 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 126.214 1.806 . . . . 0.0 115.4 177.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.29 0 C-N-CA 125.059 1.314 . . . . 0.0 113.896 178.4 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 N--CA 1.488 1.429 0 N-CA-C 111.536 0.198 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 17.9 mt -135.08 164.46 43.76 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 126.687 1.995 . . . . 0.0 111.368 -173.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -66.35 169.67 13.54 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.603 2.868 . . . . 0.0 112.859 176.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -51.74 121.66 9.02 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.741 2.961 . . . . 0.0 114.451 -174.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.82 -17.16 22.87 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 125.712 1.625 . . . . 0.0 116.161 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -73.36 139.0 45.69 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.88 1.84 . . . . 0.0 114.209 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.63 152.71 33.2 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.942 1.697 . . . . 0.0 111.42 174.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -63.72 145.12 56.35 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -146.08 162.18 38.49 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.577 1.951 . . . . 0.0 109.655 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.4 ptm -154.87 140.25 17.72 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.33 156.02 40.0 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.1 1.76 . . . . 0.0 114.885 172.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.06 -21.48 66.19 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -78.29 -3.47 43.08 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.187 1.395 . . . . 0.0 114.435 174.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.65 20.2 41.5 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 124.601 1.096 . . . . 0.0 115.199 -177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.2 m -94.62 125.08 39.04 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.867 1.333 . . . . 0.0 111.592 177.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.1 t -94.74 142.49 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.539 1.136 . . . . 0.0 110.348 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -149.46 -172.59 4.17 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.372 1.869 . . . . 0.0 109.359 175.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -127.54 144.16 51.1 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.476 1.511 . . . . 0.0 110.321 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -135.98 137.09 40.89 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.904 1.281 . . . . 0.0 111.247 -176.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -97.42 115.76 28.36 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.465 0.706 . . . . 0.0 110.85 177.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -72.89 -24.09 60.81 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.55 -40.23 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.479 1.512 . . . . 0.0 111.089 -178.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.8 p -110.15 -3.53 16.3 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -170.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.319 16.3 p30 53.84 15.04 0.74 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 128.271 2.628 . . . . 0.0 116.071 -174.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.27 156.22 39.11 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.62 1.168 . . . . 0.0 112.308 172.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.6 p -136.76 149.64 47.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.797 1.239 . . . . 0.0 111.763 173.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -155.8 145.38 21.07 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.539 1.136 . . . . 0.0 111.584 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -89.56 -38.69 13.79 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -76.8 134.9 38.96 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.433 1.093 . . . . 0.0 111.722 175.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.92 110.23 2.05 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.401 1.481 . . . . 0.0 112.312 -174.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -60.87 147.83 94.17 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 123.886 3.058 . . . . 0.0 115.733 -169.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.5 t -150.21 154.65 38.33 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.94 1.296 . . . . 0.0 111.491 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.144 0 C-N-CA 125.513 1.53 . . . . 0.0 112.805 -177.427 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 tptm . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 110.604 -0.146 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.48 149.28 61.56 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.356 1.462 . . . . 0.0 112.12 177.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -69.72 166.7 26.65 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.28 3.32 . . . . 0.0 112.419 172.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -54.26 140.06 72.46 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.832 3.021 . . . . 0.0 114.446 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.27 -24.65 3.45 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 125.578 1.561 . . . . 0.0 115.564 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -79.81 146.12 32.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.223 1.511 . . . . 0.0 114.107 177.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -145.6 157.99 43.9 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.158 2.183 . . . . 0.0 111.581 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -75.75 145.12 41.05 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.774 -0.579 . . . . 0.0 111.347 169.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -146.9 164.29 33.37 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.525 1.53 . . . . 0.0 110.103 -177.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.1 ttm -154.66 135.59 13.76 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.383 -0.823 . . . . 0.0 112.552 -171.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -72.25 158.13 36.42 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.39 1.876 . . . . 0.0 115.6 172.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.21 65.38 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.87 -3.33 50.91 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.424 1.49 . . . . 0.0 114.55 174.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.8 20.92 45.09 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.658 1.123 . . . . 0.0 115.443 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.4 m -94.57 128.55 41.27 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 118.916 1.358 . . . . 0.0 111.289 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.3 t -94.71 142.86 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.185 0.994 . . . . 0.0 110.039 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -148.66 -175.29 4.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.336 1.854 . . . . 0.0 109.274 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -125.2 143.88 50.73 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.179 1.392 . . . . 0.0 110.277 -177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -141.49 136.93 31.72 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.466 1.107 . . . . 0.0 110.494 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -96.24 119.1 34.13 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.536 0.735 . . . . 0.0 111.081 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -73.75 -23.52 59.76 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.0 mt -84.24 -40.23 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.852 1.661 . . . . 0.0 111.016 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -112.7 -3.01 14.34 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -170.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.327 15.8 p30 53.87 16.84 1.15 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.933 2.493 . . . . 0.0 116.046 -174.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.51 154.75 39.5 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.417 1.087 . . . . 0.0 111.906 171.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.2 p -144.49 146.57 32.49 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.361 1.064 . . . . 0.0 112.087 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -157.71 156.13 31.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.102 0.961 . . . . 0.0 112.3 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -85.4 -28.72 24.94 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 118.499 2.778 . . . . 0.0 118.499 -177.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -92.37 153.07 19.41 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.949 1.3 . . . . 0.0 112.162 176.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.2 ttp180 -62.82 124.4 83.27 Favored Pre-proline 0 N--CA 1.476 0.87 0 O-C-N 121.375 -0.828 . . . . 0.0 111.329 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -63.28 160.21 36.01 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.579 2.853 . . . . 0.0 114.027 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.9 p -149.04 158.97 44.6 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.329 1.451 . . . . 0.0 112.334 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.219 0 C-N-CA 125.36 1.457 . . . . 0.0 113.342 -177.093 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.5 tptt . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.747 0.308 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 44.2 mt -58.25 162.82 5.33 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 126.23 1.812 . . . . 0.0 113.331 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -66.71 170.91 11.68 Favored 'Trans proline' 0 CA--C 1.549 1.229 0 C-N-CA 123.559 2.839 . . . . 0.0 113.108 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -51.57 121.81 9.18 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.737 2.958 . . . . 0.0 114.636 -174.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.8 -16.09 22.45 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 125.682 1.61 . . . . 0.0 116.154 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -73.56 140.12 46.07 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.918 1.859 . . . . 0.0 114.189 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -149.46 154.79 39.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.674 1.59 . . . . 0.0 110.693 174.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -64.13 145.1 56.52 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 173.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -144.18 163.64 33.02 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.16 2.184 . . . . 0.0 109.651 -176.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 54.1 ttp -154.71 136.33 14.33 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.205 -0.934 . . . . 0.0 112.696 -176.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -72.1 158.04 36.66 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.194 1.798 . . . . 0.0 115.792 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.07 -22.94 66.18 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.4 p30 -80.09 -2.94 46.61 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.302 1.441 . . . . 0.0 114.43 173.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.52 20.61 47.42 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.745 1.164 . . . . 0.0 115.4 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 54.4 m -94.63 124.78 38.87 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 118.941 1.371 . . . . 0.0 111.043 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -94.64 141.91 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.391 1.076 . . . . 0.0 109.395 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.76 -170.32 3.62 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.201 1.8 . . . . 0.0 108.403 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -126.02 143.97 50.9 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.445 1.498 . . . . 0.0 110.163 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -135.69 134.88 39.61 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.163 1.385 . . . . 0.0 112.098 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -95.61 115.22 27.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.436 0.694 . . . . 0.0 110.69 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -73.41 -23.21 60.11 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -177.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.6 mt -85.1 -40.1 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.371 1.468 . . . . 0.0 111.101 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.0 p -108.74 -7.36 15.59 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 116.247 1.943 . . . . 0.0 116.247 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 60.26 13.64 4.08 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.005 2.122 . . . . 0.0 115.357 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.71 154.53 41.29 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.364 1.065 . . . . 0.0 112.404 173.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -132.95 148.33 52.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.166 1.387 . . . . 0.0 111.689 173.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -156.75 143.19 18.3 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.588 1.155 . . . . 0.0 112.0 -170.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.267 63.4 m-85 -89.86 -56.41 3.25 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 118.604 2.816 . . . . 0.0 118.604 -175.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -74.08 155.0 38.95 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.313 1.045 . . . . 0.0 111.106 171.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -54.96 118.49 17.59 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 124.515 1.126 . . . . 0.0 110.885 -173.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -54.78 137.47 74.81 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 123.823 3.016 . . . . 0.0 113.284 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.8 m 50.86 57.54 6.53 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.732 1.213 . . . . 0.0 112.739 -171.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.268 0 C-N-CA 125.473 1.511 . . . . 0.0 113.711 -178.901 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.4 mt 60.58 165.03 0.1 OUTLIER Pre-proline 0 CA--C 1.557 1.239 0 C-N-CA 127.378 2.271 . . . . 0.0 114.953 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -68.1 168.76 18.19 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 C-N-CA 123.17 2.58 . . . . 0.0 112.546 173.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -52.81 123.19 12.44 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.643 2.895 . . . . 0.0 114.285 -175.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.58 -16.92 22.72 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.538 1.542 . . . . 0.0 116.262 179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -73.83 140.31 45.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.94 1.87 . . . . 0.0 114.175 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -152.27 150.46 29.8 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.403 1.881 . . . . 0.0 111.238 178.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -66.95 145.05 55.83 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.69 167.09 22.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 127.262 2.225 . . . . 0.0 110.05 -175.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.3 ttm -154.72 134.57 12.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.617 -0.677 . . . . 0.0 112.574 -174.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -71.29 158.55 36.17 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.47 1.908 . . . . 0.0 115.994 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.47 -23.04 65.6 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 42.3 p30 -81.3 -2.73 50.16 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.278 1.431 . . . . 0.0 114.515 174.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.74 19.75 50.27 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.731 1.158 . . . . 0.0 115.511 -178.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 59.9 m -94.7 131.07 40.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 118.995 1.397 . . . . 0.0 111.253 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.4 t -94.65 143.34 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.337 1.055 . . . . 0.0 109.986 -176.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.3 -176.17 5.27 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.949 1.7 . . . . 0.0 109.536 174.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.53 144.69 48.57 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.703 1.601 . . . . 0.0 110.237 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -139.36 135.72 34.02 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.898 1.279 . . . . 0.0 111.968 -175.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -97.02 116.77 29.81 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.283 0.633 . . . . 0.0 110.799 175.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -74.01 -22.95 59.39 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -176.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.9 mt -85.06 -40.17 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 125.502 1.521 . . . . 0.0 110.989 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.0 p -110.18 -6.12 15.15 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -171.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 60.17 14.76 4.74 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.796 2.038 . . . . 0.0 115.267 -175.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.56 152.27 45.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.211 1.004 . . . . 0.0 112.183 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.0 p -140.24 142.26 35.82 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.981 1.312 . . . . 0.0 111.914 177.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -155.08 146.39 22.91 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.181 0.993 . . . . 0.0 111.915 -174.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -84.9 -40.18 17.34 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 116.763 2.134 . . . . 0.0 116.763 176.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -73.13 151.57 41.52 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.958 1.303 . . . . 0.0 111.942 170.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -61.01 125.21 83.14 Favored Pre-proline 0 CA--C 1.548 0.866 0 O-C-N 121.273 -0.892 . . . . 0.0 110.199 177.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -53.25 137.95 63.91 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.954 3.103 . . . . 0.0 113.647 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.5 t -69.14 133.36 47.91 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.978 0.911 . . . . 0.0 112.808 -171.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.24 0 C-N-CA 125.577 1.56 . . . . 0.0 112.769 -176.318 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 119.486 -0.292 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.2 mp 60.88 143.4 0.05 OUTLIER Pre-proline 0 CA--C 1.558 1.257 0 C-N-CA 128.898 2.879 . . . . 0.0 114.263 -175.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -77.23 167.57 24.53 Favored 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 123.864 3.042 . . . . 0.0 111.865 172.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -54.42 137.98 72.93 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.571 2.847 . . . . 0.0 114.587 -175.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.25 -24.69 5.32 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 125.541 1.543 . . . . 0.0 115.653 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -76.9 140.96 40.71 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 119.461 1.631 . . . . 0.0 113.785 178.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -153.48 154.38 34.27 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.945 1.698 . . . . 0.0 111.438 176.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -57.01 145.36 30.69 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -146.93 164.34 33.25 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.685 1.994 . . . . 0.0 110.5 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 53.1 ttp -154.79 135.84 13.86 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.61 -0.681 . . . . 0.0 112.615 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -71.05 158.15 36.99 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.192 1.797 . . . . 0.0 115.65 172.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 -22.98 65.99 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.2 p30 -80.36 -3.08 48.18 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.349 1.46 . . . . 0.0 114.455 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.01 20.07 48.09 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.737 1.16 . . . . 0.0 115.416 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 56.1 m -94.68 126.11 39.77 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 119.026 1.413 . . . . 0.0 111.16 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 65.5 t -94.68 142.26 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.279 1.031 . . . . 0.0 109.85 -174.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -150.34 -173.05 4.33 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.192 1.797 . . . . 0.0 109.032 177.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -128.16 141.73 51.39 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.38 1.472 . . . . 0.0 109.034 -175.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -137.98 134.16 34.55 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.831 1.253 . . . . 0.0 112.126 -170.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -92.97 114.73 27.37 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 110.678 177.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.03 -22.67 60.6 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.7 mt -85.13 -40.18 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.672 1.589 . . . . 0.0 111.056 -177.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.9 p -111.76 -6.81 14.27 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -171.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 60.76 14.13 4.87 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.766 2.026 . . . . 0.0 115.193 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.95 155.57 39.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.088 0.955 . . . . 0.0 112.217 172.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 70.8 p -141.91 145.32 34.43 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.868 1.267 . . . . 0.0 111.993 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -152.14 142.72 22.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.297 1.039 . . . . 0.0 111.703 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -79.99 -36.0 36.62 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 117.167 2.284 . . . . 0.0 117.167 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -80.85 146.43 30.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.222 1.409 . . . . 0.0 111.826 172.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.45 119.27 58.35 Favored Pre-proline 0 N--CA 1.474 0.725 0 C-N-CA 123.799 0.84 . . . . 0.0 110.218 179.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.59 144.83 50.65 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.631 2.221 . . . . 0.0 112.116 -176.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.8 m -72.26 129.87 39.46 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.943 1.297 . . . . 0.0 113.806 -172.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.397 0 C-N-CA 126.174 1.845 . . . . 0.0 114.005 -177.518 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.1 tmmm? . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 119.384 -0.341 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 24.7 mt -127.9 162.97 46.46 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 126.302 1.841 . . . . 0.0 110.745 171.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -65.21 167.53 16.17 Favored 'Trans proline' 0 CA--C 1.548 1.223 0 C-N-CA 123.292 2.661 . . . . 0.0 113.013 176.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -52.51 122.41 10.78 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.647 2.898 . . . . 0.0 114.169 -175.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.61 -17.5 19.91 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 125.58 1.562 . . . . 0.0 116.15 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -73.66 135.79 43.78 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.943 1.872 . . . . 0.0 113.832 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -145.66 163.75 33.89 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.904 1.682 . . . . 0.0 112.243 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.43 145.12 56.59 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 172.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -143.5 161.67 37.83 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 127.213 2.205 . . . . 0.0 109.769 -176.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.7 ttt -154.77 131.37 10.6 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -171.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -77.69 155.09 31.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.589 1.955 . . . . 0.0 115.514 175.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -22.36 66.82 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -79.94 -0.79 36.58 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.61 13.14 56.02 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 124.701 1.144 . . . . 0.0 115.418 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 30.9 m -94.68 127.56 40.75 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.863 1.331 . . . . 0.0 112.343 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.79 142.98 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.475 1.11 . . . . 0.0 109.701 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -149.62 -169.02 3.27 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.328 1.851 . . . . 0.0 108.83 176.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -127.46 145.37 50.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.573 1.549 . . . . 0.0 110.429 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -141.2 134.63 29.79 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.107 1.363 . . . . 0.0 112.241 -173.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -94.73 115.78 27.94 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.726 176.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -73.71 -22.42 59.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.6 mt -85.68 -40.13 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.508 1.523 . . . . 0.0 111.08 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.5 p -110.49 -6.02 15.01 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -171.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 60.35 14.66 4.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.819 2.047 . . . . 0.0 115.302 -176.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.75 152.51 45.23 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.146 0.979 . . . . 0.0 112.161 173.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 56.6 p -139.8 144.24 37.26 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.99 1.316 . . . . 0.0 111.986 177.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -156.79 143.76 18.66 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.455 1.102 . . . . 0.0 111.049 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.253 43.3 t80 -85.19 -39.22 18.08 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 177.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -70.91 141.64 51.15 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.332 1.053 . . . . 0.0 112.225 171.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.34 116.03 20.1 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.273 1.029 . . . . 0.0 111.895 -177.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -59.44 126.17 20.0 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.563 2.842 . . . . 0.0 114.77 -171.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 56.3 m 53.9 40.91 32.09 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.532 1.533 . . . . 0.0 114.928 175.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 CA-C-O 118.223 -1.32 . . . . 0.0 113.769 176.71 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 25.7 mt -124.3 163.64 34.9 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.376 1.871 . . . . 0.0 111.569 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -67.04 170.15 13.6 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 C-N-CA 123.917 3.078 . . . . 0.0 112.835 174.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -52.68 127.81 25.88 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.678 2.919 . . . . 0.0 114.035 -177.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.69 -21.27 5.56 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.592 1.567 . . . . 0.0 116.075 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -73.72 138.23 44.51 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.72 1.76 . . . . 0.0 113.943 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.72 154.7 36.82 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.157 1.783 . . . . 0.0 111.205 175.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -62.55 145.02 55.39 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -144.11 163.54 33.28 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.169 2.188 . . . . 0.0 109.74 -176.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.1 ttm -154.71 135.06 13.28 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.412 -0.805 . . . . 0.0 112.521 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -71.25 158.14 36.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.271 1.828 . . . . 0.0 115.81 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -22.57 65.42 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.83 -3.32 50.72 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.396 1.478 . . . . 0.0 114.505 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.83 21.03 44.5 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 124.721 1.153 . . . . 0.0 115.448 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.2 m -94.61 127.03 40.29 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.999 1.4 . . . . 0.0 111.237 178.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.6 t -94.65 142.96 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.431 1.092 . . . . 0.0 110.359 -176.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -151.39 -175.61 5.25 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.114 1.765 . . . . 0.0 109.199 175.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -118.93 142.67 47.56 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.955 1.302 . . . . 0.0 110.351 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -135.94 134.59 38.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.243 1.417 . . . . 0.0 112.706 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -96.31 114.62 26.32 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.432 0.693 . . . . 0.0 110.77 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -73.41 -22.84 60.13 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.6 mt -85.14 -40.16 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 125.357 1.463 . . . . 0.0 111.048 -178.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 p -108.62 -7.04 15.76 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 116.089 1.885 . . . . 0.0 116.089 -172.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 60.41 13.29 3.98 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.922 2.089 . . . . 0.0 115.313 -175.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.66 152.63 45.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.055 0.942 . . . . 0.0 112.116 173.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.1 p -138.8 145.46 40.14 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.6 1.16 . . . . 0.0 111.482 174.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -157.05 143.81 18.4 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.092 0.957 . . . . 0.0 112.286 -174.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -84.71 -38.26 19.94 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 116.079 1.881 . . . . 0.0 116.079 176.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -69.32 150.45 47.34 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.515 1.126 . . . . 0.0 111.786 171.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.98 123.45 80.09 Favored Pre-proline 0 N--CA 1.476 0.871 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.774 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -61.51 157.18 42.73 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.201 2.601 . . . . 0.0 113.165 172.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.2 m -158.12 154.66 27.83 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.507 1.523 . . . . 0.0 112.368 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.165 0 C-N-CA 125.144 1.354 . . . . 0.0 112.774 -179.637 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 66.7 mt -128.2 161.39 56.65 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 126.014 1.726 . . . . 0.0 111.834 -172.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -67.58 170.16 14.34 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.574 2.849 . . . . 0.0 112.805 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -52.09 122.87 11.33 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.7 2.933 . . . . 0.0 114.323 -175.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.43 -17.45 19.19 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.623 1.582 . . . . 0.0 116.239 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -73.17 139.08 46.09 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.807 1.804 . . . . 0.0 114.088 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.79 152.09 33.29 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.807 1.643 . . . . 0.0 111.434 174.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -59.75 145.41 45.27 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 175.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -146.5 163.08 36.86 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.56 1.944 . . . . 0.0 110.592 -178.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.6 ptp -154.91 140.1 17.54 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -178.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -74.0 156.76 37.2 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.584 1.953 . . . . 0.0 115.221 173.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -22.03 66.27 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.7 p30 -79.0 -3.18 43.79 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.23 1.412 . . . . 0.0 114.593 174.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.24 19.16 47.11 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.675 1.131 . . . . 0.0 115.469 -178.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.5 m -94.59 129.75 41.3 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 118.834 1.317 . . . . 0.0 111.613 177.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 76.9 t -94.73 142.96 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.566 1.147 . . . . 0.0 110.299 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -149.18 -171.76 3.96 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.307 1.843 . . . . 0.0 108.81 174.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -128.49 143.9 51.05 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.449 1.5 . . . . 0.0 109.885 -177.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -134.15 134.56 42.3 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.21 1.404 . . . . 0.0 112.251 -176.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -96.13 115.0 26.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.476 0.71 . . . . 0.0 110.821 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -73.48 -22.99 60.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.7 mt -85.33 -40.09 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.3 1.44 . . . . 0.0 111.053 -178.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.72 -6.85 15.74 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 60.23 13.73 4.11 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.991 2.116 . . . . 0.0 115.296 -175.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.85 153.08 43.78 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.248 1.019 . . . . 0.0 112.343 173.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.9 p -137.04 141.19 42.46 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.15 1.38 . . . . 0.0 111.496 175.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -153.39 144.02 22.61 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.158 0.983 . . . . 0.0 112.28 -172.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -83.01 -39.73 20.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 178.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -81.66 145.63 30.47 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.33 1.052 . . . . 0.0 112.199 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.67 113.31 5.77 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.978 1.311 . . . . 0.0 111.914 -176.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -60.19 129.34 29.66 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 123.706 2.937 . . . . 0.0 114.871 -170.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.6 m -86.64 148.84 25.29 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.313 1.045 . . . . 0.0 112.927 176.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.173 0 C-N-CA 125.135 1.35 . . . . 0.0 112.76 179.848 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.9 tttp . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 119.657 -0.211 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.9 mp -65.74 153.71 90.36 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 124.691 1.197 . . . . 0.0 111.579 177.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -66.59 162.08 38.56 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.415 2.744 . . . . 0.0 112.563 172.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.49 135.86 71.18 Favored 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 123.458 2.772 . . . . 0.0 114.049 -176.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.79 -14.6 18.28 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.165 1.365 . . . . 0.0 116.198 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 79.0 m95 -85.22 144.54 28.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 118.706 1.253 . . . . 0.0 113.407 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.25 150.5 33.81 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.835 1.654 . . . . 0.0 111.23 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -65.82 145.04 56.44 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 176.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -144.75 165.83 26.96 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.233 2.213 . . . . 0.0 109.571 -175.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.4 ttm -154.79 135.86 13.86 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.291 -0.881 . . . . 0.0 112.511 -173.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -70.37 158.07 36.63 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.282 1.833 . . . . 0.0 115.629 172.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.48 -22.88 65.48 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -81.31 -3.32 52.22 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.415 1.486 . . . . 0.0 114.632 174.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.95 19.59 46.57 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.631 1.11 . . . . 0.0 115.614 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.3 m -94.6 128.43 41.22 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 118.969 1.384 . . . . 0.0 111.349 178.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.57 143.86 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.359 1.064 . . . . 0.0 110.213 -174.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -150.71 -172.97 4.33 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.968 1.707 . . . . 0.0 109.759 175.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -124.67 143.7 50.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.064 1.746 . . . . 0.0 110.007 -175.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -140.76 132.7 27.66 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.838 1.255 . . . . 0.0 111.568 -170.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -91.46 120.71 32.52 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.371 0.669 . . . . 0.0 110.685 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -77.13 -20.16 55.96 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -172.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.8 mp -86.06 -40.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.818 1.247 . . . . 0.0 111.741 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 p -108.95 -7.31 15.43 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -170.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 65.1 m-80 59.91 16.11 5.48 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.521 1.928 . . . . 0.0 114.814 -175.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.54 152.93 44.82 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.955 0.902 . . . . 0.0 111.837 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.7 p -136.72 148.24 47.2 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.621 1.169 . . . . 0.0 112.265 178.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.2 tp60 -156.25 142.42 18.24 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.357 1.463 . . . . 0.0 111.348 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.345 53.1 t80 -87.17 -49.76 7.07 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 118.815 2.894 . . . . 0.0 118.815 -171.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -88.08 151.01 23.04 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.031 0.933 . . . . 0.0 110.849 169.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.3 ttp180 -54.87 121.34 34.34 Favored Pre-proline 0 N--CA 1.48 1.034 0 CA-C-N 119.056 0.844 . . . . 0.0 111.53 -169.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -62.96 148.21 93.72 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 122.991 2.46 . . . . 0.0 112.313 -175.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.7 p -67.56 141.47 56.82 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 -170.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.755 1.645 . . . . 0.0 112.491 -174.43 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 119.837 -0.125 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 72.8 mt -120.81 162.45 34.8 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 126.392 1.877 . . . . 0.0 111.327 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.36 172.66 11.85 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 123.289 2.659 . . . . 0.0 112.998 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -52.19 124.15 14.22 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.629 2.886 . . . . 0.0 114.256 -176.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.66 -16.61 18.76 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.538 1.542 . . . . 0.0 116.148 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -74.85 139.3 43.1 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.767 1.784 . . . . 0.0 114.048 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -150.85 154.1 36.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.994 1.718 . . . . 0.0 111.108 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -61.97 145.14 53.85 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 175.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.6 tpt85 -142.82 163.05 33.85 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.281 2.232 . . . . 0.0 109.468 -175.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 50.8 ttp -154.78 136.1 14.07 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.348 -0.845 . . . . 0.0 112.853 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -70.49 157.72 37.35 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.161 1.784 . . . . 0.0 115.365 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.02 -22.42 65.7 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -80.6 -3.51 50.66 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.437 1.495 . . . . 0.0 114.631 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.39 20.75 43.71 Favored Glycine 0 CA--C 1.539 1.538 0 C-N-CA 124.6 1.095 . . . . 0.0 115.397 -177.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.1 m -94.59 124.62 38.73 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.948 1.374 . . . . 0.0 111.482 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.4 t -94.75 142.81 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 124.346 1.059 . . . . 0.0 110.067 -173.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -149.47 -171.86 3.99 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.373 1.869 . . . . 0.0 109.639 176.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -123.59 142.42 51.05 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.668 1.587 . . . . 0.0 109.93 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -136.87 135.22 37.68 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.933 1.293 . . . . 0.0 112.652 -176.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -96.17 114.89 26.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.55 0.74 . . . . 0.0 110.757 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -73.82 -23.63 59.69 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.8 mt -84.8 -40.08 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.336 1.454 . . . . 0.0 111.07 -178.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 p -108.93 -7.47 15.42 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.18 1.918 . . . . 0.0 116.18 -171.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.27 15.37 5.29 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.802 2.041 . . . . 0.0 113.923 -175.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.67 155.64 40.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.052 -1.03 . . . . 0.0 112.08 172.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.1 p -141.18 150.03 42.23 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.641 1.176 . . . . 0.0 111.938 175.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -155.0 139.78 17.15 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.622 1.169 . . . . 0.0 111.3 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -78.86 -30.68 45.22 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 169.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -78.49 142.11 37.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.516 1.126 . . . . 0.0 111.858 171.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.04 120.09 54.58 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.113 0.965 . . . . 0.0 110.918 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.31 133.11 17.25 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.378 2.719 . . . . 0.0 113.378 -169.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t 58.97 175.8 0.07 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.53 1.932 . . . . 0.0 114.145 -174.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.265 0 C-N-CA 125.769 1.652 . . . . 0.0 112.843 -178.419 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 119.473 -0.299 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 80.7 mt -75.33 163.37 68.13 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 124.604 1.161 . . . . 0.0 111.518 169.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -69.14 167.76 22.7 Favored 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 123.346 2.697 . . . . 0.0 112.523 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -53.26 122.9 12.01 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.516 2.811 . . . . 0.0 113.937 -175.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.11 -15.14 45.86 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 125.474 1.512 . . . . 0.0 116.287 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -73.76 134.94 43.53 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 120.002 1.901 . . . . 0.0 114.109 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -145.51 162.04 38.33 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.85 2.06 . . . . 0.0 111.444 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -69.8 145.09 52.42 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.442 -0.786 . . . . 0.0 112.994 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -143.24 165.2 28.12 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.291 2.236 . . . . 0.0 109.835 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 43.2 ttm -154.63 134.25 12.78 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.362 -0.836 . . . . 0.0 112.512 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -71.26 158.58 36.14 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.334 1.853 . . . . 0.0 115.438 172.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.89 -22.44 65.56 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.2 p30 -81.0 -3.66 52.47 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.439 1.496 . . . . 0.0 114.625 174.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.04 22.24 39.19 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.538 1.066 . . . . 0.0 115.331 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 40.9 m -94.59 126.95 40.21 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.902 1.351 . . . . 0.0 111.116 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.7 t -94.69 142.67 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.195 0.998 . . . . 0.0 109.954 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -151.83 -174.29 4.81 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.947 1.699 . . . . 0.0 108.801 176.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -120.51 143.65 48.44 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.47 1.508 . . . . 0.0 110.637 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -142.66 136.11 28.75 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.598 1.159 . . . . 0.0 111.561 -172.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -94.77 117.0 29.42 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.252 0.621 . . . . 0.0 110.814 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -72.69 -22.98 60.82 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.3 mt -86.09 -40.08 14.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.708 1.603 . . . . 0.0 111.102 -177.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -112.12 -3.55 14.67 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.272 1.953 . . . . 0.0 116.272 -170.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.331 15.7 p30 53.69 17.36 1.21 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.89 2.476 . . . . 0.0 115.979 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.2 152.68 44.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.338 1.055 . . . . 0.0 111.931 170.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.6 p -141.02 148.65 40.62 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.8 1.24 . . . . 0.0 112.154 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -158.64 146.27 17.94 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.585 1.154 . . . . 0.0 111.804 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -84.36 -39.35 19.19 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 117.108 2.262 . . . . 0.0 117.108 177.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -72.47 152.2 42.07 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.253 1.021 . . . . 0.0 111.939 170.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -66.12 127.3 93.12 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.68 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -59.4 165.69 8.87 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 123.925 3.083 . . . . 0.0 114.818 175.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.5 m -59.22 147.17 36.49 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.408 1.483 . . . . 0.0 114.829 -172.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.274 0 CA-C-O 117.661 -1.633 . . . . 0.0 112.752 -179.017 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.7 pttm . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.3 mp -107.39 159.08 31.5 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 126.201 1.8 . . . . 0.0 111.87 -176.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -65.09 165.61 21.24 Favored 'Trans proline' 0 CA--C 1.549 1.238 0 C-N-CA 123.965 3.11 . . . . 0.0 112.992 175.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -52.65 129.25 31.49 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 123.747 2.964 . . . . 0.0 114.826 -171.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.24 -22.44 3.73 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 125.705 1.622 . . . . 0.0 115.795 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -75.1 138.97 42.46 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.637 1.718 . . . . 0.0 113.771 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -147.37 165.52 29.94 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.685 1.994 . . . . 0.0 112.054 176.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -65.68 145.19 56.33 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -144.24 162.3 36.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.983 2.113 . . . . 0.0 110.082 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 52.3 ttp -154.73 137.24 15.07 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.439 -0.788 . . . . 0.0 112.811 -177.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -71.09 157.99 37.24 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.179 1.792 . . . . 0.0 115.461 172.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -23.09 65.88 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 178.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.9 p30 -81.02 -3.19 50.92 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.349 1.46 . . . . 0.0 114.537 174.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.43 19.99 46.87 Favored Glycine 0 CA--C 1.539 1.57 0 C-N-CA 124.61 1.1 . . . . 0.0 115.5 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.9 m -94.62 126.14 39.72 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.952 1.376 . . . . 0.0 111.344 177.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 72.0 t -94.65 142.12 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.255 1.022 . . . . 0.0 110.175 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -148.43 -168.73 3.17 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.55 1.94 . . . . 0.0 108.83 174.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -130.32 147.11 51.99 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.512 1.125 . . . . 0.0 109.591 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -142.48 134.59 27.38 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.56 1.544 . . . . 0.0 112.473 -169.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -92.96 116.17 28.8 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.331 0.653 . . . . 0.0 110.875 175.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -73.77 -22.01 59.99 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -176.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.6 mt -86.31 -40.19 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.668 1.587 . . . . 0.0 111.133 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.7 p -110.39 -6.26 15.01 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -171.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 60.52 14.82 5.12 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.783 2.033 . . . . 0.0 115.239 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.0 152.49 45.19 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.244 1.018 . . . . 0.0 111.984 172.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.1 p -140.38 143.73 35.85 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.925 1.29 . . . . 0.0 112.139 178.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -155.84 141.72 18.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.418 1.087 . . . . 0.0 111.145 -177.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . 0.254 43.3 t80 -80.48 -37.01 32.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 177.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -70.65 145.36 50.68 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.48 1.112 . . . . 0.0 112.314 169.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.69 116.21 24.63 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.74 1.216 . . . . 0.0 111.165 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.23 148.01 38.42 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.7 2.933 . . . . 0.0 113.433 -169.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.4 p -154.31 162.47 41.15 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.822 1.249 . . . . 0.0 112.306 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.151 0 C-N-CA 125.167 1.365 . . . . 0.0 112.848 -178.964 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.3 tmmm? . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 45.9 mt 60.47 163.12 0.1 Allowed Pre-proline 0 CA--C 1.558 1.268 0 C-N-CA 127.385 2.274 . . . . 0.0 114.399 -171.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -68.46 170.5 14.81 Favored 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 123.493 2.795 . . . . 0.0 112.654 174.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -51.93 122.19 10.06 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.792 2.995 . . . . 0.0 114.447 -175.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.18 -17.62 17.12 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.678 1.609 . . . . 0.0 116.228 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -74.09 139.91 44.94 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.866 1.833 . . . . 0.0 114.028 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -152.04 155.72 38.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.055 1.742 . . . . 0.0 110.606 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -65.49 145.07 56.58 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.096 -1.002 . . . . 0.0 113.335 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -144.53 162.36 36.78 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 127.058 2.143 . . . . 0.0 109.648 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.8 ptp -154.82 140.11 17.64 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -72.77 159.12 34.3 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.302 1.841 . . . . 0.0 115.347 174.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.39 -22.77 66.4 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 178.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 p30 -80.27 -0.71 37.66 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.156 1.383 . . . . 0.0 114.491 173.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.12 18.76 55.17 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.664 1.126 . . . . 0.0 115.371 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 88.9 m -94.73 128.3 41.33 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.678 1.239 . . . . 0.0 110.974 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.3 t -94.7 143.2 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.644 1.178 . . . . 0.0 110.429 -176.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -150.49 -173.57 4.5 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.27 1.828 . . . . 0.0 109.036 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -122.54 141.89 51.2 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.172 1.389 . . . . 0.0 110.547 -178.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -136.6 135.5 38.42 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.942 1.297 . . . . 0.0 112.232 -173.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -96.72 115.61 27.73 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.471 0.709 . . . . 0.0 110.739 176.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -73.36 -22.99 60.15 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -85.47 -40.09 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.457 1.503 . . . . 0.0 111.001 -178.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.3 p -108.89 -7.14 15.51 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -171.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 60.33 13.78 4.23 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.932 2.093 . . . . 0.0 115.288 -175.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.83 153.93 42.66 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.227 1.011 . . . . 0.0 112.272 173.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 65.5 p -143.17 139.02 30.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.08 1.352 . . . . 0.0 111.876 179.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -154.87 154.11 32.19 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.539 0.735 . . . . 0.0 112.616 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -85.32 -39.42 17.69 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 117.743 2.497 . . . . 0.0 117.743 -178.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -78.33 154.22 31.02 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.17 1.388 . . . . 0.0 111.312 174.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -64.96 125.73 89.71 Favored Pre-proline 0 CA--C 1.55 0.949 0 O-C-N 121.198 -0.938 . . . . 0.0 111.429 -176.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -58.6 157.68 26.5 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 124.143 3.228 . . . . 0.0 114.679 177.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 t -149.51 154.0 38.09 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.127 1.371 . . . . 0.0 111.401 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.129 0 C-N-CA 125.386 1.47 . . . . 0.0 112.729 -177.061 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_