data_6jpp_residue ############################ # Computer software used # ############################ 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 6jpp _Structure_validation_residue.Date_analyzed 2020-03-27 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 ' 7' ' ' ILE . . . . . . . . . . . . . 54.1 mt . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.6 m -131.94 129.9 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.029 1.331 . . . . 0.0 112.399 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -76.35 141.61 41.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.123 0.969 . . . . 0.0 111.264 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.87 156.11 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.753 1.621 . . . . 0.0 111.512 -177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.89 121.58 41.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.669 1.188 . . . . 0.0 109.786 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.9 mt -109.68 125.42 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.224 1.01 . . . . 0.0 110.474 -170.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -81.55 148.28 29.23 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.167 1.387 . . . . 0.0 113.375 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -155.89 142.9 13.6 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.108 1.763 . . . . 0.0 110.093 168.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -60.56 140.14 89.67 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.756 2.304 . . . . 0.0 113.823 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.58 12.84 70.69 Favored Glycine 0 CA--C 1.539 1.577 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.96 153.58 48.2 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.173 1.389 . . . . 0.0 112.611 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -69.59 150.07 96.86 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.492 0.717 . . . . 0.0 110.936 169.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -59.66 131.07 38.11 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.39 2.06 . . . . 0.0 113.332 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -80.05 114.51 19.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.721 1.209 . . . . 0.0 110.429 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.36 129.96 35.59 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.282 0.633 . . . . 0.0 109.706 169.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 23.9 ptm -154.68 177.13 11.58 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.117 0.967 . . . . 0.0 111.689 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -119.3 124.03 45.67 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.23 1.012 . . . . 0.0 111.211 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.7 mt -90.72 110.06 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 125.531 1.532 . . . . 0.0 108.575 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.1 t0 -83.33 118.3 23.59 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.731 0.813 . . . . 0.0 109.774 169.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -65.47 -12.33 51.59 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.12 -25.19 29.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.597 1.089 . . . . 0.0 113.716 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -78.29 148.76 74.82 Favored Pre-proline 0 N--CA 1.48 1.042 0 C-N-CA 124.455 1.102 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.44 141.75 47.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.888 2.392 . . . . 0.0 110.963 173.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -61.49 -30.96 70.94 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 123.107 0.563 . . . . 0.0 112.293 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -59.45 -43.96 93.06 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.038 0.836 . . . . 0.0 112.53 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.76 81.4 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.944 -0.472 . . . . 0.0 111.985 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.06 -48.43 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.33 0.652 . . . . 0.0 110.432 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.39 -38.87 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.619 1.168 . . . . 0.0 111.051 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -59.68 -40.19 87.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.502 0.721 . . . . 0.0 112.174 171.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -71.72 -24.76 61.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.454 1.102 . . . . 0.0 113.618 174.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 23.1 t -68.93 -62.22 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.727 1.149 . . . . 0.0 110.615 169.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.1 p -64.66 -33.64 76.43 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.81 0.844 . . . . 0.0 112.659 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.76 -28.67 68.9 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.827 0.851 . . . . 0.0 112.873 172.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.79 -23.16 68.92 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.333 0.968 . . . . 0.0 114.163 174.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -114.18 12.07 17.68 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.94 1.696 . . . . 0.0 113.296 172.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.0 m 54.88 27.68 9.39 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.982 1.713 . . . . 0.0 114.479 -175.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.4 mt -76.81 127.49 32.85 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.133 1.373 . . . . 0.0 110.57 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.52 164.17 25.64 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.686 1.194 . . . . 0.0 113.462 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 53.64 68.23 0.88 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.313 1.845 . . . . 0.0 113.64 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -60.73 -21.95 63.49 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.072 -1.017 . . . . 0.0 113.496 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -54.98 -28.32 50.81 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 112.923 171.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -77.3 -18.33 57.6 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.399 1.08 . . . . 0.0 113.027 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -98.07 158.74 15.37 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -168.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.03 154.51 42.59 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.702 2.401 . . . . 0.0 110.061 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -87.3 150.49 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.42 0.629 . . . . 0.0 109.851 168.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -137.14 143.44 42.47 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.411 1.884 . . . . 0.0 109.181 -176.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 . . . . . 0 N--CA 1.471 0.6 0 C-N-CA 123.225 0.61 . . . . 0.0 110.543 171.734 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 mm -76.32 135.65 26.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.664 0.745 . . . . 0.0 110.797 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.4 p -143.3 173.7 11.37 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.586 2.355 . . . . 0.0 109.136 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -57.08 -22.53 40.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -90.0 -52.89 4.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.436 . . . . 0.0 112.161 169.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.7 -17.04 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -171.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.31 -28.08 40.0 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.521 1.128 . . . . 0.0 113.665 169.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -72.48 -15.93 61.8 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.203 1.001 . . . . 0.0 113.442 177.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.83 -14.14 59.42 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.902 0.881 . . . . 0.0 112.945 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.3 mt -74.8 134.0 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 124.556 1.143 . . . . 0.0 110.016 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 168.02 14.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.713 2.005 . . . . 0.0 112.28 174.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.76 123.76 18.43 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.69 -0.631 . . . . 0.0 111.176 174.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.53 34.15 36.57 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.1 0.857 . . . . 0.0 114.084 -172.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.0 m -79.06 132.45 36.62 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.168 1.484 . . . . 0.0 110.716 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mt -86.44 113.21 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.6 mt -109.0 177.18 4.84 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.123 1.769 . . . . 0.0 110.869 176.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.6 ttt85 -145.64 137.93 25.6 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.56 1.944 . . . . 0.0 110.294 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 tp -82.69 136.98 34.59 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.557 0.743 . . . . 0.0 110.06 171.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.8 t -156.84 152.32 26.7 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.049 0.94 . . . . 0.0 110.834 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.7 p -72.14 135.29 46.14 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.714 -1.241 . . . . 0.0 110.976 172.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 CA--C 1.54 0.592 0 C-N-CA 125.322 1.449 . . . . 0.0 113.554 -170.541 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.3 mt . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 120.541 0.21 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.0 m -133.41 132.46 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.701 1.6 . . . . 0.0 112.068 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -75.74 138.43 41.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.305 1.042 . . . . 0.0 111.306 175.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m -139.92 157.56 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.351 1.461 . . . . 0.0 111.949 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -111.8 143.58 42.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.811 1.244 . . . . 0.0 109.708 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.6 mt -130.07 125.1 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.761 0.824 . . . . 0.0 110.622 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -86.63 144.81 26.99 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.587 1.555 . . . . 0.0 112.898 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -154.72 142.8 14.27 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 125.815 1.646 . . . . 0.0 110.415 169.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.34 140.28 75.98 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.733 2.288 . . . . 0.0 113.51 -174.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.77 14.08 69.74 Favored Glycine 0 CA--C 1.539 1.534 0 N-CA-C 115.31 0.884 . . . . 0.0 115.31 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.45 156.62 48.36 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.274 1.429 . . . . 0.0 112.805 -177.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -69.08 150.96 97.37 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.918 0.887 . . . . 0.0 111.396 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.17 125.88 18.08 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.792 2.328 . . . . 0.0 111.914 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -83.65 114.83 21.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.89 0.876 . . . . 0.0 110.523 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.6 mt -81.81 134.49 35.43 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.859 0.864 . . . . 0.0 109.815 169.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ppp? -158.36 178.98 9.57 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.575 1.15 . . . . 0.0 111.607 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -124.88 119.75 29.7 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.414 1.086 . . . . 0.0 111.309 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.1 mt -86.11 114.01 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 125.115 1.366 . . . . 0.0 109.085 174.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -88.8 117.24 27.64 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.004 0.922 . . . . 0.0 109.108 168.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -66.43 -14.47 62.22 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -88.12 -17.38 31.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.944 1.297 . . . . 0.0 113.906 172.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -79.32 147.01 67.82 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-N 119.628 1.103 . . . . 0.0 111.462 172.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.35 141.48 51.62 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.823 2.349 . . . . 0.0 111.086 175.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.96 -30.71 70.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.944 -0.551 . . . . 0.0 112.212 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m -59.92 -43.56 94.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.187 0.903 . . . . 0.0 112.734 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -39.32 79.71 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.793 -0.567 . . . . 0.0 111.975 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 83.8 mt -63.63 -48.45 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.503 0.721 . . . . 0.0 110.438 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.1 mt -61.58 -38.49 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.334 1.053 . . . . 0.0 110.768 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.06 -42.6 90.71 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 119.066 0.848 . . . . 0.0 112.146 170.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -69.01 -30.07 68.38 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.364 1.066 . . . . 0.0 112.974 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.49 -53.51 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 121.46 -0.775 . . . . 0.0 110.612 169.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -60.83 -43.49 98.19 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.776 0.83 . . . . 0.0 112.072 -176.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.88 -29.93 69.85 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.074 0.949 . . . . 0.0 112.891 175.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.99 -23.93 64.29 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.365 0.984 . . . . 0.0 114.295 174.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.4 m0 -115.57 14.21 16.51 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.907 1.683 . . . . 0.0 113.234 172.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.85 28.09 11.93 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.056 1.742 . . . . 0.0 114.346 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.1 mt -74.25 122.99 23.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.029 1.331 . . . . 0.0 111.283 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.56 164.56 26.44 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.489 1.116 . . . . 0.0 112.336 172.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.2 m120 54.85 50.58 15.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.243 1.417 . . . . 0.0 113.59 173.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -57.42 -20.69 31.73 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.151 0.98 . . . . 0.0 113.385 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -54.99 -28.83 54.97 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.229 1.412 . . . . 0.0 113.072 171.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -78.9 -16.45 57.01 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.222 1.009 . . . . 0.0 112.989 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -92.78 159.26 15.48 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.76 148.87 34.63 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.089 2.156 . . . . 0.0 110.202 171.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.0 mt -81.5 153.19 26.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.462 0.648 . . . . 0.0 109.586 167.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -150.56 150.28 31.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.495 . . . . 0.0 109.331 -170.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 . . . . . 0 N--CA 1.474 0.771 0 O-C-N 120.945 -1.097 . . . . 0.0 112.082 178.03 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.467 0.416 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.3 mm -80.08 131.03 35.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.652 0.739 . . . . 0.0 110.711 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 45.5 p -148.39 171.76 15.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.214 2.206 . . . . 0.0 109.321 -173.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.79 -21.54 60.96 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.905 -1.122 . . . . 0.0 113.288 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -84.02 -28.07 27.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.472 1.509 . . . . 0.0 113.564 173.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -109.53 -21.25 12.55 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -170.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.07 -25.15 65.16 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -173.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -62.66 -22.4 66.42 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.693 1.197 . . . . 0.0 113.298 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -74.48 -14.66 60.85 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.913 0.885 . . . . 0.0 113.033 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 69.7 mt -73.26 132.74 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.475 1.11 . . . . 0.0 109.876 174.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -125.8 169.78 12.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.28 1.832 . . . . 0.0 112.283 174.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -58.99 128.22 36.12 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.742 -0.599 . . . . 0.0 111.08 173.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.88 8.76 78.88 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.93 1.252 . . . . 0.0 115.417 -175.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.9 m -64.83 133.57 52.21 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 119.643 1.722 . . . . 0.0 111.179 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.3 mt -95.32 121.33 45.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.576 0.75 . . . . 0.0 109.194 170.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.5 mt -113.25 175.2 5.55 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.846 2.058 . . . . 0.0 110.555 177.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -139.07 148.7 43.68 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.295 1.838 . . . . 0.0 110.257 169.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.7 tp -89.68 139.53 30.47 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.47 1.108 . . . . 0.0 110.327 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.66 154.41 28.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.206 1.002 . . . . 0.0 110.823 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 29.1 p -73.16 136.7 44.82 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.768 -1.208 . . . . 0.0 110.76 169.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 CA--C 1.538 0.489 0 C-N-CA 125.057 1.343 . . . . 0.0 112.167 -174.842 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mt . . . . . 0 N--CA 1.471 0.593 0 CA-C-O 120.717 0.294 . . . . 0.0 111.452 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.61 131.59 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.622 1.569 . . . . 0.0 112.272 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -79.08 137.81 37.68 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.734 1.214 . . . . 0.0 110.886 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.43 160.17 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.89 1.676 . . . . 0.0 112.341 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.41 116.95 26.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.261 . . . . 0.0 110.356 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.2 mt -105.1 126.49 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.911 0.885 . . . . 0.0 111.007 -171.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -84.02 142.31 30.56 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.848 1.659 . . . . 0.0 112.849 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -155.27 142.58 13.81 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 125.918 1.687 . . . . 0.0 110.424 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.21 145.53 93.41 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.708 2.272 . . . . 0.0 114.008 -175.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.14 12.25 71.73 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.508 0.963 . . . . 0.0 115.508 177.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.5 158.08 43.93 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.279 1.431 . . . . 0.0 112.536 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -70.06 155.21 93.83 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 123.84 0.856 . . . . 0.0 111.52 169.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -59.48 130.0 33.66 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.814 2.342 . . . . 0.0 112.698 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -80.19 106.71 12.4 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.024 0.93 . . . . 0.0 109.982 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 60.4 mt -76.05 125.16 28.61 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.625 0.77 . . . . 0.0 109.401 169.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -153.95 178.26 10.12 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -114.91 125.75 54.0 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.154 0.982 . . . . 0.0 111.152 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.3 mt -88.43 108.58 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 170.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -80.87 114.21 19.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.095 0.558 . . . . 0.0 109.774 169.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -68.29 -11.24 59.11 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -76.81 -34.65 57.91 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.373 0.988 . . . . 0.0 112.802 169.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -76.97 145.13 73.36 Favored Pre-proline 0 N--CA 1.481 1.075 0 C-N-CA 125.283 1.433 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.86 142.87 64.54 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.046 2.497 . . . . 0.0 111.17 175.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -59.1 -32.94 70.27 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-O 118.545 -0.74 . . . . 0.0 112.29 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.41 -41.52 85.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.64 1.109 . . . . 0.0 112.563 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.97 72.69 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.072 0.549 . . . . 0.0 112.254 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.67 -46.73 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.195 0.598 . . . . 0.0 110.332 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.4 mt -60.42 -38.57 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 125.043 1.337 . . . . 0.0 110.935 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -57.05 -46.92 82.07 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.246 0.93 . . . . 0.0 111.565 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -67.22 -28.57 68.18 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.509 1.124 . . . . 0.0 113.324 177.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.79 -52.33 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.523 1.056 . . . . 0.0 110.023 169.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.5 m -61.8 -44.27 97.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.901 0.881 . . . . 0.0 111.793 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -59.11 -29.21 67.21 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.12 1.368 . . . . 0.0 112.905 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.07 -23.47 66.02 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.401 1.0 . . . . 0.0 114.469 173.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -117.33 13.7 14.59 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.032 1.733 . . . . 0.0 113.23 172.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t 55.52 28.53 11.89 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.115 1.766 . . . . 0.0 114.351 -176.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.5 mt -74.21 125.29 28.07 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.314 1.446 . . . . 0.0 111.458 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.68 163.61 27.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.53 1.132 . . . . 0.0 112.516 174.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 54.25 53.29 11.17 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.637 1.575 . . . . 0.0 113.89 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 -58.26 -18.11 24.22 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.171 0.988 . . . . 0.0 113.562 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -55.84 -28.84 58.34 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.986 1.315 . . . . 0.0 113.008 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -79.68 -15.84 56.83 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.03 0.932 . . . . 0.0 112.771 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -94.43 159.27 15.18 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.625 1.202 . . . . 0.0 114.11 -169.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.32 151.24 36.26 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.396 2.278 . . . . 0.0 110.105 173.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.0 mt -82.33 156.64 24.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 166.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -148.87 150.08 32.37 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.649 1.18 . . . . 0.0 110.496 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 . . . . . 0 N--CA 1.472 0.655 0 O-C-N 121.608 -0.682 . . . . 0.0 112.795 173.601 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 120.911 0.386 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 41.6 mm -81.51 134.21 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.228 1.011 . . . . 0.0 110.307 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -143.95 168.9 18.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.271 1.828 . . . . 0.0 109.661 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.21 -13.5 28.38 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.685 -1.259 . . . . 0.0 113.213 174.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -99.07 -6.75 27.86 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.633 1.973 . . . . 0.0 114.282 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.58 -15.97 4.39 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.094 1.358 . . . . 0.0 113.969 -173.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.95 -19.53 62.84 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -62.31 -22.51 66.11 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.843 1.257 . . . . 0.0 112.838 173.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -75.56 -13.45 60.35 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.108 0.963 . . . . 0.0 113.253 176.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.92 131.26 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.184 0.994 . . . . 0.0 109.603 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -124.61 169.85 11.52 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.912 1.685 . . . . 0.0 111.791 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -57.13 126.1 25.68 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 111.278 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.22 11.06 76.63 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.075 1.322 . . . . 0.0 115.445 -176.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.3 m -67.26 128.8 37.75 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.626 1.713 . . . . 0.0 111.405 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -83.36 126.23 40.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 169.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.7 mt -121.47 175.56 6.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.678 1.991 . . . . 0.0 110.867 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 73.8 ttt-85 -137.53 133.53 34.63 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 127.364 2.266 . . . . 0.0 110.033 176.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.5 tp -81.86 137.48 35.23 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 167.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.0 t -157.08 152.76 26.84 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.134 0.574 . . . . 0.0 111.239 -175.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.1 p -70.62 138.94 51.22 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.131 -0.981 . . . . 0.0 109.304 167.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.543 0.707 0 C-N-CA 126.022 1.729 . . . . 0.0 112.003 -178.834 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.9 mt . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 m -134.36 132.45 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.349 1.46 . . . . 0.0 111.489 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -77.16 144.09 38.62 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.53 155.19 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 125.922 1.689 . . . . 0.0 111.391 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.9 112.95 21.02 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.563 1.145 . . . . 0.0 110.331 175.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.2 mt -102.52 126.4 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.909 0.884 . . . . 0.0 111.075 -169.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -82.24 146.87 29.26 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.14 1.776 . . . . 0.0 113.215 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -154.25 141.39 13.45 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 125.854 1.662 . . . . 0.0 110.232 168.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.54 138.1 73.58 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.664 2.243 . . . . 0.0 113.463 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.07 12.77 72.15 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.309 0.883 . . . . 0.0 115.309 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.85 152.96 50.85 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.222 1.409 . . . . 0.0 112.641 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -68.99 150.67 97.54 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 123.898 0.879 . . . . 0.0 111.072 170.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.37 129.68 30.78 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.471 2.114 . . . . 0.0 113.179 -179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -80.57 110.75 16.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.608 1.163 . . . . 0.0 110.36 176.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.3 mt -77.33 126.54 31.09 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.487 0.715 . . . . 0.0 109.818 169.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.0 ptm -155.02 177.46 11.3 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.291 1.036 . . . . 0.0 111.555 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -112.74 136.07 52.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.962 0.905 . . . . 0.0 112.6 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.8 mt -96.78 109.49 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 125.563 1.545 . . . . 0.0 107.914 169.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -84.56 116.84 23.36 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -66.98 -11.78 57.86 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -86.62 -22.54 26.13 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.747 1.219 . . . . 0.0 113.63 170.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -82.12 142.82 48.14 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.324 1.05 . . . . 0.0 111.57 175.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.57 144.9 68.39 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.403 2.736 . . . . 0.0 111.621 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.5 mt -60.33 -32.67 71.46 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.084 176.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 m -58.85 -42.9 90.43 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.418 1.008 . . . . 0.0 112.583 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.56 -39.4 77.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.067 0.547 . . . . 0.0 111.981 174.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.46 -46.35 95.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.523 0.729 . . . . 0.0 110.687 176.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.8 mt -60.84 -38.24 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.93 1.292 . . . . 0.0 111.281 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.04 -38.7 89.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.4 0.68 . . . . 0.0 112.251 171.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.34 -24.74 62.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.235 1.014 . . . . 0.0 113.195 173.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.6 t -69.87 -58.04 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 119.604 1.093 . . . . 0.0 110.704 169.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 15.3 p -63.74 -33.52 75.83 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.502 0.721 . . . . 0.0 112.654 -169.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -61.43 -26.98 68.23 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.58 1.152 . . . . 0.0 113.045 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.36 -22.86 71.48 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.279 0.942 . . . . 0.0 114.225 174.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -119.03 11.81 12.56 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.985 1.714 . . . . 0.0 113.27 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 m 54.5 29.92 12.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.025 1.73 . . . . 0.0 114.376 -175.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.9 mt -77.6 127.03 31.8 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.542 1.137 . . . . 0.0 110.445 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.18 160.6 27.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.522 1.129 . . . . 0.0 113.445 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 51.55 69.11 0.7 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.774 2.03 . . . . 0.0 113.261 170.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -60.56 -18.83 55.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.546 1.138 . . . . 0.0 113.72 -176.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -54.75 -28.28 47.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.227 1.411 . . . . 0.0 112.933 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -78.29 -17.93 55.95 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.859 0.863 . . . . 0.0 113.204 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -99.21 158.58 15.59 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -168.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.79 149.83 33.09 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.597 1.959 . . . . 0.0 110.256 171.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.4 mt -76.56 154.67 34.28 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.445 0.64 . . . . 0.0 109.43 167.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -148.58 156.58 42.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.279 1.831 . . . . 0.0 108.808 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 . . . . . 0 N--CA 1.473 0.722 0 O-C-N 120.74 -1.225 . . . . 0.0 111.984 170.822 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 . . . . . 0 CA--C 1.537 0.472 0 CA-C-O 121.311 0.577 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.4 mm -80.71 134.35 27.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 123.942 0.897 . . . . 0.0 110.586 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -131.78 163.1 28.95 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.38 1.872 . . . . 0.0 111.029 -176.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -61.7 -16.24 47.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -86.04 -52.68 5.54 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.938 1.295 . . . . 0.0 112.693 169.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -86.67 -12.24 48.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -169.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.8 ptm180 -54.64 -23.42 17.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.972 1.309 . . . . 0.0 114.269 173.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -65.35 -18.61 65.45 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.11 1.364 . . . . 0.0 113.363 175.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -80.59 -12.68 59.48 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 113.533 173.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -71.0 134.26 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.902 0.881 . . . . 0.0 109.776 175.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -121.38 165.26 15.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.501 1.52 . . . . 0.0 112.219 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -60.53 123.16 16.55 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.001 0.52 . . . . 0.0 110.985 177.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.43 11.0 63.08 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.259 1.409 . . . . 0.0 115.476 -174.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.3 m -66.15 129.71 40.73 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.729 1.765 . . . . 0.0 110.973 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.2 mt -85.11 125.18 40.39 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.7 mt -119.06 -179.42 3.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.682 1.993 . . . . 0.0 110.714 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.5 ttp-105 -145.89 135.47 23.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 127.637 2.375 . . . . 0.0 110.09 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.5 tp -84.45 138.25 32.92 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.592 0.757 . . . . 0.0 109.827 169.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.2 t -160.15 155.55 25.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.996 0.918 . . . . 0.0 110.369 -177.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.0 p -70.33 148.82 48.02 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.743 -1.223 . . . . 0.0 111.183 170.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.5 p . . . . . 0 CA--C 1.546 0.822 0 C-N-CA 124.77 1.228 . . . . 0.0 113.916 -171.955 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.9 mt . . . . . 0 N--CA 1.472 0.665 0 CA-C-O 120.591 0.234 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.3 m -133.11 135.05 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.636 1.574 . . . . 0.0 111.928 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -76.11 142.52 41.66 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.078 0.951 . . . . 0.0 111.676 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.7 m -142.34 157.31 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.563 1.545 . . . . 0.0 111.889 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.06 123.09 43.62 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.869 1.268 . . . . 0.0 110.029 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -111.09 126.09 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.02 0.928 . . . . 0.0 110.836 -170.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -83.54 142.23 31.03 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.033 1.733 . . . . 0.0 112.733 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -155.06 142.72 14.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.89 1.676 . . . . 0.0 110.535 170.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.32 142.98 88.03 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.681 2.254 . . . . 0.0 113.78 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.05 13.83 70.23 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 177.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.0 157.45 45.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.198 1.399 . . . . 0.0 112.645 -176.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -69.05 152.46 96.77 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.826 0.85 . . . . 0.0 111.411 170.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -60.33 128.4 26.07 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.737 2.291 . . . . 0.0 112.36 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -81.25 111.22 17.46 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.939 0.895 . . . . 0.0 110.283 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -78.32 128.69 34.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.579 0.752 . . . . 0.0 109.592 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.1 ptm -154.99 178.59 10.02 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.706 0.802 . . . . 0.0 112.418 174.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 -112.08 129.74 56.12 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.791 1.237 . . . . 0.0 111.481 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.9 mt -97.76 111.76 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 125.259 1.424 . . . . 0.0 108.362 170.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -85.95 117.36 24.75 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.966 -0.754 . . . . 0.0 108.966 169.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -66.24 -14.76 62.45 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -80.78 -30.81 35.96 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.139 1.375 . . . . 0.0 113.664 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -73.55 143.22 82.0 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 124.188 0.995 . . . . 0.0 111.377 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.85 142.39 62.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.015 2.477 . . . . 0.0 111.108 177.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -59.36 -32.43 70.11 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.539 -0.744 . . . . 0.0 112.173 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m -58.51 -41.86 86.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.624 1.102 . . . . 0.0 112.76 176.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.78 -40.9 72.31 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.064 0.546 . . . . 0.0 112.127 175.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.61 -46.09 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.399 0.68 . . . . 0.0 110.533 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.36 -37.34 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.826 1.251 . . . . 0.0 110.969 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -61.26 -41.94 97.78 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.477 1.035 . . . . 0.0 112.243 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -66.84 -28.51 68.41 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.392 1.077 . . . . 0.0 112.959 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.0 -54.29 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.374 0.988 . . . . 0.0 110.177 168.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -61.22 -41.77 97.44 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.222 1.009 . . . . 0.0 112.137 -174.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.05 -29.85 68.8 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.142 0.977 . . . . 0.0 112.925 175.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.91 -23.35 65.59 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.348 0.975 . . . . 0.0 114.403 174.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -117.54 14.41 14.53 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.982 1.713 . . . . 0.0 113.177 172.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.67 28.58 12.28 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.099 1.76 . . . . 0.0 114.337 -177.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.6 mt -74.79 127.36 32.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.17 1.388 . . . . 0.0 111.622 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.63 165.51 24.18 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.689 1.196 . . . . 0.0 112.461 173.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 53.96 54.77 9.24 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.558 1.543 . . . . 0.0 113.629 173.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -58.31 -21.2 48.31 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.928 0.891 . . . . 0.0 112.987 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -56.61 -28.14 59.75 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.548 1.539 . . . . 0.0 112.827 175.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -80.63 -17.5 51.08 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.967 0.907 . . . . 0.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -90.77 159.9 16.07 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.539 1.162 . . . . 0.0 113.869 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.24 151.27 37.31 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.789 2.436 . . . . 0.0 109.828 172.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.7 mt -82.92 158.61 22.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 166.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -149.4 145.64 27.06 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 124.648 1.179 . . . . 0.0 110.494 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.0 m-70 . . . . . 0 N--CA 1.473 0.712 0 O-C-N 121.67 -0.644 . . . . 0.0 110.996 171.946 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 . . . . . 0 CA--C 1.541 0.603 0 CA-C-O 120.758 0.313 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mm -83.82 133.86 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.77 1.228 . . . . 0.0 110.549 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.3 p -144.55 165.73 27.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 127.005 2.122 . . . . 0.0 110.178 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.19 -11.91 17.13 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 121.041 -1.037 . . . . 0.0 113.344 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -90.46 -20.96 22.13 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.765 1.626 . . . . 0.0 114.585 176.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -135.51 -2.41 2.45 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -173.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.49 -22.16 12.08 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 175.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -62.59 -18.49 62.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.172 1.389 . . . . 0.0 113.415 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -73.38 -14.72 61.33 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.5 mt -72.87 128.82 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.92 0.888 . . . . 0.0 109.601 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -120.13 174.56 6.41 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.112 1.765 . . . . 0.0 112.246 172.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -57.52 130.46 46.42 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.907 -0.495 . . . . 0.0 111.24 170.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.56 10.93 83.77 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 124.71 1.148 . . . . 0.0 115.367 -177.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 90.3 m -65.67 129.65 40.5 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.618 1.709 . . . . 0.0 110.967 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 35.1 mt -86.28 122.07 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 170.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.3 mt -118.57 174.66 6.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.155 1.782 . . . . 0.0 111.082 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.2 ttt-85 -138.57 135.07 34.63 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 127.338 2.255 . . . . 0.0 109.851 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -83.24 136.66 34.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.048 0.539 . . . . 0.0 109.651 168.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.1 t -158.26 149.26 20.78 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.776 0.83 . . . . 0.0 110.82 -174.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.6 p -71.54 132.97 45.45 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.655 -1.278 . . . . 0.0 110.627 170.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 CA--C 1.539 0.548 0 C-N-CA 125.125 1.37 . . . . 0.0 112.196 -176.056 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.1 mt . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.7 m -133.2 131.71 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.23 1.412 . . . . 0.0 111.945 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -77.46 138.58 39.33 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.957 0.903 . . . . 0.0 111.168 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -137.47 157.07 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.7 1.6 . . . . 0.0 111.62 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.91 132.4 55.33 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.266 1.026 . . . . 0.0 109.886 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.0 mt -121.28 123.55 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.042 0.937 . . . . 0.0 110.628 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -82.46 143.85 30.86 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.151 1.381 . . . . 0.0 112.899 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -156.09 143.8 14.07 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.915 1.686 . . . . 0.0 110.161 169.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -62.77 144.98 94.71 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.665 2.243 . . . . 0.0 113.918 -175.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.0 11.48 74.46 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.82 155.66 44.21 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.192 1.397 . . . . 0.0 112.585 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -70.09 152.53 95.77 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 123.507 0.723 . . . . 0.0 110.955 169.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -59.21 130.76 37.59 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.45 2.1 . . . . 0.0 113.408 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -78.47 118.09 20.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.726 1.21 . . . . 0.0 110.488 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.1 131.48 35.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.292 0.637 . . . . 0.0 109.404 168.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.8 ptm -155.73 176.71 12.26 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.145 0.978 . . . . 0.0 111.644 172.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -115.31 129.82 56.72 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.149 0.98 . . . . 0.0 111.745 176.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.8 mt -95.44 112.36 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 125.8 1.64 . . . . 0.0 108.504 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -86.32 116.99 24.84 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.353 1.061 . . . . 0.0 109.966 171.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -68.2 -13.36 62.18 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -78.76 -31.03 46.02 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.338 0.972 . . . . 0.0 113.184 169.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -77.03 144.88 72.73 Favored Pre-proline 0 N--CA 1.48 1.034 0 C-N-CA 123.984 0.914 . . . . 0.0 112.042 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.2 143.26 70.43 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.124 2.55 . . . . 0.0 111.214 175.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.34 -30.28 69.43 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.117 -0.944 . . . . 0.0 112.672 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.1 t -57.97 -47.14 83.84 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.246 1.385 . . . . 0.0 112.097 173.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.62 -40.34 95.32 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.63 -0.669 . . . . 0.0 112.13 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 94.3 mt -67.1 -45.93 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.672 0.789 . . . . 0.0 110.815 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.8 mt -61.36 -35.82 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.646 1.179 . . . . 0.0 110.645 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 tttp -62.55 -41.16 98.72 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.12 0.873 . . . . 0.0 112.394 171.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -65.37 -30.44 71.27 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.234 1.014 . . . . 0.0 113.101 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.59 -54.52 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 119.375 0.989 . . . . 0.0 110.247 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.3 m -61.36 -42.47 98.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.444 1.098 . . . . 0.0 112.089 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -60.2 -29.53 68.78 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.11 0.964 . . . . 0.0 112.859 175.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.61 -23.37 64.97 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.49 1.043 . . . . 0.0 114.364 174.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.57 16.09 14.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.939 1.696 . . . . 0.0 113.14 172.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.9 p 56.19 21.21 5.06 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.241 2.217 . . . . 0.0 115.505 -176.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.35 126.86 30.94 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.428 1.491 . . . . 0.0 111.649 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.87 164.33 24.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.697 1.199 . . . . 0.0 112.388 173.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 52.98 62.01 2.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.74 1.616 . . . . 0.0 113.464 173.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -61.17 -19.19 61.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.807 0.843 . . . . 0.0 112.808 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -53.25 -30.14 36.57 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.005 1.722 . . . . 0.0 113.198 170.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -76.69 -14.84 59.92 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.142 0.977 . . . . 0.0 113.046 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -102.38 158.55 16.12 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.886 1.275 . . . . 0.0 114.247 -168.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.77 150.97 39.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.258 2.223 . . . . 0.0 109.852 169.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.93 154.58 26.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 166.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -145.11 143.71 30.53 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.516 1.126 . . . . 0.0 109.896 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.7 m-70 . . . . . 0 N--CA 1.473 0.724 0 O-C-N 121.659 -0.651 . . . . 0.0 111.699 174.01 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 121.103 0.477 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -80.99 137.53 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.1 0.96 . . . . 0.0 110.109 174.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 15.5 p -144.28 168.43 20.07 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.507 1.923 . . . . 0.0 109.447 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -63.78 -4.19 2.97 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 177.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -118.89 -15.61 9.34 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.389 1.476 . . . . 0.0 114.662 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -90.12 -22.71 21.64 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.86 1.209 . . . . 0.0 113.633 173.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -59.4 -19.82 50.16 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -173.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -63.64 -24.61 67.86 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.332 1.053 . . . . 0.0 113.056 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -74.83 -16.08 60.71 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.834 0.854 . . . . 0.0 113.097 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.6 mt -71.06 133.33 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.102 0.961 . . . . 0.0 109.841 173.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -129.7 171.37 12.72 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.364 1.865 . . . . 0.0 111.328 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -60.24 121.32 11.66 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.911 -0.493 . . . . 0.0 110.312 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.16 8.56 81.61 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.849 1.214 . . . . 0.0 115.459 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.3 m -63.38 130.72 45.64 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.893 1.847 . . . . 0.0 110.564 173.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mt -91.65 123.61 43.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 123.351 0.66 . . . . 0.0 109.425 173.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -114.96 174.27 6.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.556 1.942 . . . . 0.0 110.943 177.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -137.49 136.05 37.36 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 127.082 2.153 . . . . 0.0 109.745 173.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.0 tp -79.47 136.72 37.0 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.25 0.62 . . . . 0.0 110.009 169.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.6 t -155.07 147.53 24.07 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.564 0.746 . . . . 0.0 111.036 -176.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -71.23 130.62 41.89 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.879 -1.138 . . . . 0.0 110.532 171.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.7 p . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 125.231 1.412 . . . . 0.0 114.371 -168.407 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 mt . . . . . 0 N--CA 1.471 0.58 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -134.37 133.33 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.434 1.494 . . . . 0.0 111.883 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -75.05 142.15 43.78 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.121 0.969 . . . . 0.0 110.767 174.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m -141.55 156.77 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.807 1.643 . . . . 0.0 111.223 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.75 124.77 50.44 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.376 1.07 . . . . 0.0 110.269 171.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mt -112.46 123.76 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.334 1.054 . . . . 0.0 110.761 -170.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -79.55 144.34 34.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 112.817 174.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -154.65 143.29 14.65 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.777 1.631 . . . . 0.0 110.359 169.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -63.88 142.1 80.73 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.592 2.195 . . . . 0.0 113.6 -173.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.52 70.94 Favored Glycine 0 CA--C 1.539 1.533 0 N-CA-C 115.378 0.911 . . . . 0.0 115.378 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.16 154.91 46.1 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.259 1.424 . . . . 0.0 112.558 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -70.15 151.71 95.91 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 123.692 0.797 . . . . 0.0 111.177 169.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -59.43 130.64 36.6 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.502 2.135 . . . . 0.0 113.377 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -80.22 117.9 21.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.544 1.137 . . . . 0.0 110.637 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt -79.73 130.84 35.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 168.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.5 ptm -154.57 179.51 8.97 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.296 1.038 . . . . 0.0 111.226 171.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -122.25 125.74 46.7 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.137 0.975 . . . . 0.0 111.753 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.4 mt -89.78 116.74 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 C-N-CA 125.638 1.575 . . . . 0.0 108.932 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -89.9 113.25 24.83 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.088 1.355 . . . . 0.0 109.715 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -69.61 -11.7 61.05 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -88.97 -15.99 32.84 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.51 1.124 . . . . 0.0 113.79 170.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -79.06 149.04 72.73 Favored Pre-proline 0 N--CA 1.481 1.103 0 CA-C-N 119.831 1.196 . . . . 0.0 112.203 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.48 146.25 84.64 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.899 2.4 . . . . 0.0 110.984 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 mt -63.49 -27.94 69.62 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 118.529 -0.748 . . . . 0.0 112.264 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.5 t -59.0 -45.99 89.29 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.663 1.119 . . . . 0.0 112.423 171.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.48 99.25 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.584 -0.697 . . . . 0.0 112.078 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 53.3 mt -65.18 -49.02 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.595 0.758 . . . . 0.0 110.877 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.7 mt -61.74 -36.31 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.122 0.969 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.31 -43.62 92.63 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.114 0.87 . . . . 0.0 112.21 170.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -66.94 -27.53 67.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.362 1.065 . . . . 0.0 113.079 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 16.0 t -68.37 -57.48 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 CA-C-N 119.576 1.08 . . . . 0.0 110.358 169.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.6 m -60.98 -40.86 95.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.259 1.024 . . . . 0.0 112.522 -173.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -61.12 -27.66 68.54 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.45 -23.68 68.71 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.391 0.996 . . . . 0.0 114.413 174.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -116.27 16.03 15.85 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.802 1.641 . . . . 0.0 113.146 172.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 m 55.22 26.6 8.62 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.977 1.711 . . . . 0.0 114.557 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.2 mt -73.57 125.33 27.73 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.079 1.352 . . . . 0.0 111.164 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.6 155.7 37.55 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.404 1.081 . . . . 0.0 112.507 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 49.46 71.6 0.37 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.62 1.968 . . . . 0.0 113.144 173.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 -60.85 -16.99 47.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.472 1.109 . . . . 0.0 112.944 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -52.07 -29.36 21.07 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.155 1.782 . . . . 0.0 113.101 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -75.51 -15.24 60.42 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.12 160.74 14.6 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -167.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.68 150.21 38.37 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.995 2.118 . . . . 0.0 110.127 169.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.05 154.48 28.11 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 166.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -147.43 147.13 29.9 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.676 1.19 . . . . 0.0 110.456 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 . . . . . 0 N--CA 1.474 0.753 0 O-C-N 121.448 -0.783 . . . . 0.0 110.945 171.792 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 . . . . . 0 CA--C 1.537 0.477 0 N-CA-C 110.453 -0.202 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 40.2 mm -78.08 132.26 32.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.884 0.874 . . . . 0.0 110.443 176.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.5 p -139.4 164.94 28.53 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 111.232 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -63.75 -6.76 6.13 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.802 1.241 . . . . 0.0 113.608 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -107.31 -8.08 16.49 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.169 1.788 . . . . 0.0 114.021 176.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -134.02 -5.28 2.74 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -55.9 -23.81 33.68 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -62.05 -21.72 65.15 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.251 1.42 . . . . 0.0 113.272 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -74.63 -14.17 60.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.012 0.925 . . . . 0.0 112.999 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.2 mt -71.55 130.61 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.046 0.938 . . . . 0.0 109.428 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -123.08 168.89 11.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.093 1.757 . . . . 0.0 112.255 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -60.86 123.41 17.46 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.768 -0.583 . . . . 0.0 110.942 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.71 11.3 64.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.268 1.413 . . . . 0.0 115.557 -174.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.2 m -65.73 131.87 47.37 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.704 1.752 . . . . 0.0 111.058 176.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mt -87.27 121.65 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -118.28 178.79 4.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.597 1.959 . . . . 0.0 110.551 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -144.44 136.32 26.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 126.759 2.023 . . . . 0.0 109.936 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.7 tp -82.77 138.15 34.12 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.131 0.572 . . . . 0.0 109.885 169.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.3 t -154.77 151.3 28.52 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.996 0.918 . . . . 0.0 110.409 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.4 p -68.9 131.81 45.7 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.89 -1.131 . . . . 0.0 110.396 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.8 t . . . . . 0 CA--C 1.543 0.702 0 C-N-CA 126.808 2.043 . . . . 0.0 112.79 -176.423 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.7 mt . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.4 m -132.51 131.87 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.988 1.315 . . . . 0.0 111.646 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.22 143.6 47.07 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.738 0.815 . . . . 0.0 110.635 172.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m -139.65 150.67 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.983 1.713 . . . . 0.0 110.988 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.37 109.54 19.23 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.558 1.143 . . . . 0.0 109.751 173.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.8 mt -99.8 124.59 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 123.848 0.859 . . . . 0.0 109.988 -173.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -93.29 149.37 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.254 1.422 . . . . 0.0 112.612 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -153.18 142.89 15.04 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.957 1.703 . . . . 0.0 110.276 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -59.99 138.9 85.01 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.698 2.265 . . . . 0.0 113.77 -175.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.85 12.8 75.08 Favored Glycine 0 CA--C 1.539 1.584 0 N-CA-C 115.436 0.934 . . . . 0.0 115.436 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.41 156.84 47.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.195 1.398 . . . . 0.0 112.912 -177.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -72.38 155.55 91.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 124.368 1.067 . . . . 0.0 111.15 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -65.89 129.26 21.61 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.554 2.169 . . . . 0.0 112.06 -177.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -79.42 106.05 11.17 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.321 1.448 . . . . 0.0 109.853 174.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.6 mt -75.38 126.89 31.92 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.338 0.655 . . . . 0.0 109.453 169.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.0 ptm -153.13 177.76 10.47 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.213 1.005 . . . . 0.0 111.462 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -117.06 129.93 56.33 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.002 0.921 . . . . 0.0 112.023 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.0 mt -92.39 109.28 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.343 1.457 . . . . 0.0 108.462 170.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -83.98 119.56 25.06 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -66.65 -11.18 52.75 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -176.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -86.76 -23.56 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.011 1.324 . . . . 0.0 113.856 171.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -78.56 141.31 60.5 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.454 1.024 . . . . 0.0 111.372 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.71 144.28 59.27 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.278 2.652 . . . . 0.0 111.628 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.71 -31.01 71.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.377 -0.82 . . . . 0.0 112.762 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -59.18 -46.83 87.39 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.874 1.215 . . . . 0.0 111.98 174.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.6 -39.64 91.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.589 -0.694 . . . . 0.0 112.329 176.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.81 -48.67 85.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.491 0.716 . . . . 0.0 110.513 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -62.7 -37.1 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.71 1.204 . . . . 0.0 110.977 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.53 -39.72 84.86 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.545 0.738 . . . . 0.0 112.038 170.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -73.26 -24.73 60.49 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.711 1.204 . . . . 0.0 113.762 173.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 32.3 t -69.31 -61.23 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.644 1.111 . . . . 0.0 110.587 169.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.8 p -64.08 -34.32 77.77 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.797 0.839 . . . . 0.0 112.624 -170.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.71 -29.24 69.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.879 0.872 . . . . 0.0 112.906 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.79 -23.54 67.4 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.406 1.003 . . . . 0.0 114.171 174.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -115.0 11.53 16.51 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.71 . . . . 0.0 113.288 172.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.65 29.34 13.48 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.088 1.755 . . . . 0.0 114.282 -176.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.0 mt -79.1 131.23 36.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.22 1.408 . . . . 0.0 110.705 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.89 164.43 22.64 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.697 1.199 . . . . 0.0 113.623 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 53.14 68.87 0.77 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.403 1.881 . . . . 0.0 113.749 170.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -62.65 -21.01 65.37 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.229 -0.92 . . . . 0.0 113.068 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -54.78 -31.01 58.25 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.737 1.615 . . . . 0.0 113.117 171.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -77.12 -21.0 54.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.791 0.837 . . . . 0.0 112.68 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.71 158.96 15.28 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 122.731 1.253 . . . . 0.0 114.002 -169.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.9 154.07 39.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.058 2.543 . . . . 0.0 109.585 174.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 34.1 mt -86.4 154.05 21.47 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 167.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -144.92 145.76 31.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.354 1.061 . . . . 0.0 110.561 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 . . . . . 0 N--CA 1.471 0.616 0 O-C-N 122.014 -0.429 . . . . 0.0 111.755 174.48 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 120.813 0.34 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.6 mm -83.6 135.05 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.847 0.859 . . . . 0.0 110.52 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.6 p -145.52 168.0 21.65 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.815 2.046 . . . . 0.0 109.119 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -62.0 -16.72 53.65 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 121.123 -0.985 . . . . 0.0 113.171 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -88.33 -34.56 17.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.664 1.586 . . . . 0.0 113.529 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -92.84 -25.43 18.11 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -57.27 -25.17 58.78 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -171.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -67.87 -15.3 63.56 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.354 1.062 . . . . 0.0 113.51 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -78.87 -16.19 57.37 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.5 mt -67.08 139.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.743 1.217 . . . . 0.0 110.09 175.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -126.79 161.63 27.74 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.405 1.482 . . . . 0.0 111.703 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -61.66 119.61 9.01 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.894 -0.504 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.47 10.71 60.29 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 125.333 1.444 . . . . 0.0 115.625 -174.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.9 m -63.66 132.44 51.09 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.615 1.707 . . . . 0.0 111.709 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.3 mt -86.62 125.33 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.566 0.747 . . . . 0.0 109.388 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -122.29 172.37 8.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.329 1.852 . . . . 0.0 111.156 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtm105 -131.09 143.73 50.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.531 1.932 . . . . 0.0 110.584 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.36 136.63 34.28 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 166.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.0 t -157.24 151.95 25.54 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.728 0.811 . . . . 0.0 111.044 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.8 p -72.23 136.66 46.43 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.674 -1.266 . . . . 0.0 110.846 171.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 CA--C 1.542 0.654 0 C-N-CA 125.516 1.527 . . . . 0.0 113.164 -173.003 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.5 mt . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -130.9 133.51 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.114 1.366 . . . . 0.0 112.209 -178.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -71.29 141.71 50.5 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.187 0.995 . . . . 0.0 111.518 171.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -141.28 153.05 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.46 1.504 . . . . 0.0 111.838 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.68 116.52 28.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.945 1.298 . . . . 0.0 109.966 173.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.9 mt -107.41 120.75 59.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.162 0.985 . . . . 0.0 110.607 -170.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -81.16 149.08 29.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.217 1.407 . . . . 0.0 112.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -152.53 142.88 15.26 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.798 1.639 . . . . 0.0 109.97 169.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -62.14 136.47 60.7 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.512 2.141 . . . . 0.0 113.416 -172.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.09 12.53 71.92 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 115.214 0.845 . . . . 0.0 115.214 -179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.41 154.32 50.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.098 1.359 . . . . 0.0 112.892 -177.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -68.83 153.8 95.56 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 124.433 1.093 . . . . 0.0 111.633 172.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -66.07 125.6 14.39 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.62 2.213 . . . . 0.0 111.68 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -77.74 110.64 12.77 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 110.415 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -75.94 127.09 32.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.294 0.638 . . . . 0.0 109.86 169.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 21.9 ptm -151.72 -178.0 6.45 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.259 1.024 . . . . 0.0 111.837 173.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -120.5 132.6 55.27 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.421 1.088 . . . . 0.0 112.117 176.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.3 mt -96.72 111.87 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.416 1.486 . . . . 0.0 108.836 171.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.69 115.44 20.95 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -67.23 -10.77 53.97 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -90.16 -22.55 21.67 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.743 1.217 . . . . 0.0 113.866 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -87.37 145.56 37.89 Favored Pre-proline 0 N--CA 1.482 1.152 0 CA-C-N 119.667 1.122 . . . . 0.0 111.336 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.36 146.42 56.4 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.272 2.648 . . . . 0.0 112.74 -173.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.88 -31.6 71.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.343 0.657 . . . . 0.0 112.533 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.3 m -60.27 -42.2 94.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.24 0.927 . . . . 0.0 112.471 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.07 78.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.194 0.598 . . . . 0.0 111.914 175.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.52 -49.05 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.288 0.635 . . . . 0.0 110.751 174.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 56.4 mt -61.35 -37.54 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.04 0.936 . . . . 0.0 111.146 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -59.33 -45.98 89.86 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.031 0.832 . . . . 0.0 111.974 170.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -68.89 -26.11 64.94 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.831 1.252 . . . . 0.0 113.094 177.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 67.1 t -68.01 -60.83 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 119.185 0.902 . . . . 0.0 109.505 168.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.2 m -58.02 -36.54 72.86 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.34 1.456 . . . . 0.0 113.381 -170.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -59.18 -27.9 66.12 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.194 0.998 . . . . 0.0 113.526 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.01 -27.28 73.24 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.326 -0.859 . . . . 0.0 114.205 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -106.48 13.81 27.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.454 1.502 . . . . 0.0 112.756 173.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.2 m 55.56 27.46 10.42 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.128 1.771 . . . . 0.0 114.211 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.2 mt -75.9 114.31 14.38 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.64 1.176 . . . . 0.0 110.909 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.75 162.0 30.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.357 1.063 . . . . 0.0 112.049 173.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 54.37 55.69 7.8 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.403 1.481 . . . . 0.0 113.332 176.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -57.76 -17.74 17.41 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 113.368 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -56.37 -28.58 59.62 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.11 1.364 . . . . 0.0 112.966 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -78.32 -14.86 59.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.158 0.983 . . . . 0.0 112.73 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -94.42 157.75 15.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.56 1.144 . . . . 0.0 114.054 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.51 145.65 31.14 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.13 2.172 . . . . 0.0 109.715 176.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -79.95 145.32 32.67 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.532 0.682 . . . . 0.0 109.593 168.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -134.06 146.85 50.71 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.371 1.869 . . . . 0.0 108.83 -176.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 . . . . . 0 N--CA 1.468 0.472 0 O-C-N 121.466 -0.771 . . . . 0.0 112.578 176.018 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.469 0.506 0 CA-C-O 120.758 0.313 . . . . 0.0 110.421 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.7 mm -75.11 130.11 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 123.438 0.695 . . . . 0.0 110.333 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.0 p -140.22 164.12 30.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.888 1.675 . . . . 0.0 110.845 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -60.6 -15.3 26.64 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.218 -0.926 . . . . 0.0 113.056 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -89.26 -15.03 34.52 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.078 1.751 . . . . 0.0 114.671 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -135.41 -7.21 2.25 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -174.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -57.16 -21.22 31.28 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -61.22 -21.58 63.98 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.914 1.286 . . . . 0.0 113.173 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.18 -13.97 60.5 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.201 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 80.4 mt -71.32 131.94 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.334 1.054 . . . . 0.0 109.778 174.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -116.23 170.37 8.58 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 112.507 171.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -58.79 128.58 37.92 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.912 -0.493 . . . . 0.0 111.013 169.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.1 9.46 76.84 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 124.961 1.267 . . . . 0.0 115.251 -176.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.7 m -64.96 130.19 42.48 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.546 1.673 . . . . 0.0 111.326 177.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.6 124.48 40.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.436 0.694 . . . . 0.0 109.321 170.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -122.38 177.79 5.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.991 2.116 . . . . 0.0 110.28 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -144.53 136.73 26.26 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.75 2.02 . . . . 0.0 110.019 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.0 tp -82.32 137.44 34.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.341 0.656 . . . . 0.0 109.999 169.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.5 t -157.26 159.45 37.62 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.168 0.987 . . . . 0.0 110.555 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.2 p -72.08 144.69 48.6 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.72 -1.238 . . . . 0.0 110.548 169.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.544 0.724 0 C-N-CA 125.729 1.612 . . . . 0.0 113.029 -174.903 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.471 0.591 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -132.08 134.29 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.656 1.583 . . . . 0.0 111.413 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.1 143.03 35.93 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.02 0.928 . . . . 0.0 110.992 174.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.93 157.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.737 1.615 . . . . 0.0 111.459 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.21 115.91 26.85 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.637 1.175 . . . . 0.0 110.033 172.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.1 mt -104.65 125.16 59.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 123.833 0.853 . . . . 0.0 110.333 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -89.16 144.34 26.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.887 1.275 . . . . 0.0 112.316 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -153.79 143.99 15.59 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.104 1.762 . . . . 0.0 110.068 173.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -62.79 145.06 94.7 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.724 2.283 . . . . 0.0 113.985 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 11.34 75.08 Favored Glycine 0 CA--C 1.539 1.552 0 N-CA-C 115.484 0.954 . . . . 0.0 115.484 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.7 156.82 44.66 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.215 1.406 . . . . 0.0 112.64 -177.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -69.55 153.77 95.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 123.767 0.827 . . . . 0.0 111.314 169.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.74 128.98 28.76 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.516 2.144 . . . . 0.0 112.907 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -81.0 112.08 18.07 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.91 1.284 . . . . 0.0 110.365 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -76.64 127.5 32.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.455 0.702 . . . . 0.0 109.62 169.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -153.89 171.6 18.72 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.171 0.988 . . . . 0.0 111.538 177.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -114.85 124.54 52.0 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.796 0.838 . . . . 0.0 112.82 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.0 mt -91.6 110.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 125.705 1.602 . . . . 0.0 108.5 174.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -85.48 117.07 24.17 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.779 0.832 . . . . 0.0 109.259 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -67.23 -13.32 61.86 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -84.26 -23.14 30.51 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.613 1.165 . . . . 0.0 113.45 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -79.94 148.03 67.38 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 124.569 1.148 . . . . 0.0 111.926 177.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.58 141.25 49.78 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.748 2.299 . . . . 0.0 111.041 175.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.38 -31.63 70.53 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.002 0.521 . . . . 0.0 112.004 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -59.82 -42.64 93.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.211 0.914 . . . . 0.0 112.804 175.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.34 79.74 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.823 -0.548 . . . . 0.0 111.99 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.57 -48.18 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.669 0.787 . . . . 0.0 110.523 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -62.68 -35.76 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 124.075 0.95 . . . . 0.0 110.757 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -60.13 -44.09 95.18 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.401 1.001 . . . . 0.0 112.28 170.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -67.48 -34.02 76.31 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.421 1.088 . . . . 0.0 112.932 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.88 -53.17 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.917 0.887 . . . . 0.0 111.119 172.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 86.6 m -59.87 -42.57 94.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.819 0.848 . . . . 0.0 112.076 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.47 -27.89 68.89 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.641 0.776 . . . . 0.0 112.971 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.8 -23.64 65.67 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.457 1.027 . . . . 0.0 114.289 172.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -115.23 16.61 16.87 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.02 1.728 . . . . 0.0 113.161 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 56.29 25.14 9.0 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 126.049 1.739 . . . . 0.0 114.732 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.4 mt -75.13 122.89 24.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.236 1.414 . . . . 0.0 111.712 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 163.36 27.66 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.145 . . . . 0.0 112.168 171.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 53.06 52.95 12.77 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.454 1.501 . . . . 0.0 113.181 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -57.73 -24.76 58.53 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.146 0.979 . . . . 0.0 112.811 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -63.48 -12.71 33.96 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.321 1.448 . . . . 0.0 113.937 173.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -81.56 -17.45 48.36 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.309 -0.87 . . . . 0.0 112.739 168.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -94.98 160.96 14.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 122.637 1.208 . . . . 0.0 113.951 -169.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.66 152.51 42.51 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.721 2.409 . . . . 0.0 109.479 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.0 mt -82.81 155.59 24.11 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -143.4 144.03 31.88 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.442 1.097 . . . . 0.0 110.614 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 176.827 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.4 mm -82.65 132.52 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.625 0.77 . . . . 0.0 110.725 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.0 p -148.9 172.3 14.91 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.244 2.217 . . . . 0.0 109.275 -174.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.58 -20.74 57.89 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.802 -1.186 . . . . 0.0 113.325 172.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.22 -18.8 23.83 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.528 1.531 . . . . 0.0 113.72 175.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -114.87 -19.27 11.06 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -174.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -61.14 -23.12 65.3 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.528 1.306 . . . . 0.0 114.528 -175.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -63.94 -22.83 67.1 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.949 1.3 . . . . 0.0 113.184 173.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -75.26 -13.6 60.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 112.864 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.1 mt -74.14 128.66 36.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.4 1.08 . . . . 0.0 109.514 172.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -113.5 173.67 6.29 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.415 1.486 . . . . 0.0 111.946 169.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -61.69 130.88 47.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.692 -0.63 . . . . 0.0 111.14 170.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.14 9.98 83.28 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 125.143 1.354 . . . . 0.0 115.646 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 88.7 m -65.95 131.74 46.96 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 119.637 1.719 . . . . 0.0 111.736 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 51.1 mt -85.34 127.73 39.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 123.574 0.75 . . . . 0.0 109.351 169.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.4 mt -124.05 171.78 9.49 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.841 2.056 . . . . 0.0 110.855 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -133.38 136.2 45.16 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 127.077 2.151 . . . . 0.0 110.229 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -82.27 137.57 34.81 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 168.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.8 t -156.76 150.09 24.25 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.776 0.83 . . . . 0.0 111.44 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.6 p -70.54 127.51 32.96 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.748 -1.22 . . . . 0.0 110.287 170.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.2 t . . . . . 0 CA--C 1.537 0.46 0 C-N-CA 125.197 1.399 . . . . 0.0 112.703 -172.466 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.9 mt . . . . . 0 N--CA 1.469 0.521 0 CA-C-O 120.765 0.317 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.9 m -134.22 131.3 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.005 1.322 . . . . 0.0 112.609 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -67.52 141.5 56.87 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.167 0.987 . . . . 0.0 110.952 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.1 m -142.03 153.55 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.797 1.239 . . . . 0.0 112.062 175.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.06 120.55 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.921 1.288 . . . . 0.0 109.602 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.0 mt -107.92 122.21 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.645 0.778 . . . . 0.0 110.593 -171.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -84.9 149.67 25.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.981 1.712 . . . . 0.0 113.187 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -156.74 142.2 12.58 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.038 1.735 . . . . 0.0 110.27 169.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -60.59 137.45 73.65 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.642 2.228 . . . . 0.0 113.506 -176.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.87 12.56 74.94 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.28 154.13 51.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.252 1.421 . . . . 0.0 112.61 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.07 152.82 92.75 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.659 0.784 . . . . 0.0 111.435 169.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -61.43 131.73 37.53 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.581 2.188 . . . . 0.0 113.063 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -82.77 109.05 16.58 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.105 0.962 . . . . 0.0 110.023 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.6 mt -74.83 132.04 41.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.41 0.684 . . . . 0.0 110.081 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ptp -154.02 179.97 8.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.218 1.007 . . . . 0.0 111.964 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -123.41 125.38 44.85 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.729 1.211 . . . . 0.0 111.338 171.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.6 mt -86.79 110.96 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 124.629 1.172 . . . . 0.0 108.891 172.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -82.99 121.59 27.2 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.152 0.981 . . . . 0.0 108.462 167.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -69.8 -10.38 58.19 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -86.38 -15.18 41.22 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.473 1.286 . . . . 0.0 114.473 169.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -87.79 140.72 31.39 Favored Pre-proline 0 N--CA 1.479 0.994 0 CA-C-N 120.071 1.305 . . . . 0.0 111.142 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 144.09 62.51 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.315 2.676 . . . . 0.0 111.443 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 mt -59.68 -33.4 71.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.94 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.57 -43.75 89.53 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.26 0.936 . . . . 0.0 112.637 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.73 -38.94 77.03 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.95 0.5 . . . . 0.0 112.147 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.87 -47.27 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.476 0.71 . . . . 0.0 110.422 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.1 mt -62.52 -36.24 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.903 1.281 . . . . 0.0 111.144 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -61.86 -39.55 92.27 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.954 0.797 . . . . 0.0 112.385 170.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -70.01 -27.09 64.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.987 0.915 . . . . 0.0 113.278 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.7 t -69.39 -57.37 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.58 1.082 . . . . 0.0 110.82 169.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.5 p -63.96 -34.41 77.91 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.499 0.72 . . . . 0.0 112.557 -169.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.99 -27.61 68.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.31 1.044 . . . . 0.0 113.064 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.53 -22.98 70.12 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.305 0.955 . . . . 0.0 114.045 174.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -120.57 13.79 11.76 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.136 1.774 . . . . 0.0 113.106 176.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.4 m 55.77 29.22 13.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.249 1.82 . . . . 0.0 114.515 -178.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.91 128.2 33.17 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.659 1.183 . . . . 0.0 110.403 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.49 165.7 20.98 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.744 1.218 . . . . 0.0 113.35 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 53.87 63.1 2.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.121 1.769 . . . . 0.0 113.746 170.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -60.39 -19.98 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -177.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -57.32 -26.23 60.59 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.24 1.416 . . . . 0.0 113.193 171.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -81.37 -19.6 42.34 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.989 0.916 . . . . 0.0 112.782 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -92.09 157.88 16.51 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.583 1.182 . . . . 0.0 113.943 -169.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.32 154.38 41.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.014 2.526 . . . . 0.0 109.736 175.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.9 mt -89.69 151.19 21.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 167.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -142.05 147.0 36.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.636 1.174 . . . . 0.0 110.137 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 . . . . . 0 N--CA 1.472 0.67 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 177.853 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 120.673 0.273 . . . . 0.0 111.305 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 35.0 mm -80.3 132.81 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.37 1.068 . . . . 0.0 110.339 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 19.5 p -140.42 163.67 32.19 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.746 1.618 . . . . 0.0 111.023 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -61.27 -12.64 14.16 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.088 -1.008 . . . . 0.0 113.197 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -94.62 -15.24 24.18 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.156 1.782 . . . . 0.0 114.472 176.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -132.93 -7.73 3.09 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -176.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.95 -22.73 16.02 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -64.87 -18.26 65.01 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.569 1.548 . . . . 0.0 113.556 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -78.98 -14.54 59.15 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.097 0.959 . . . . 0.0 113.579 176.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.51 141.79 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 124.944 1.298 . . . . 0.0 110.101 174.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -127.4 160.87 30.1 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.212 1.405 . . . . 0.0 111.723 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -60.08 124.46 20.29 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.806 -0.559 . . . . 0.0 111.326 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.08 9.04 68.11 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.168 1.366 . . . . 0.0 115.174 -174.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 96.2 m -65.03 129.06 38.33 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.581 1.69 . . . . 0.0 111.105 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.0 mt -83.46 123.19 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 169.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -116.26 176.19 5.21 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.712 2.005 . . . . 0.0 110.161 174.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 33.5 ttp85 -143.94 135.94 26.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 126.367 1.867 . . . . 0.0 110.158 177.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 tp -77.64 140.53 39.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.844 0.858 . . . . 0.0 110.604 172.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.9 t -159.27 152.41 22.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.076 0.95 . . . . 0.0 111.425 -176.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 p -75.55 134.2 40.79 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.502 -1.374 . . . . 0.0 110.69 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 40.1 t . . . . . 0 CA--C 1.544 0.728 0 C-N-CA 125.336 1.454 . . . . 0.0 113.625 -172.884 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 N--CA 1.471 0.591 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.03 131.09 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.896 1.278 . . . . 0.0 112.03 -174.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -75.5 140.85 43.05 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.068 0.947 . . . . 0.0 110.568 172.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -140.79 155.56 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.54 1.536 . . . . 0.0 111.241 -178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.53 143.94 38.51 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.24 1.016 . . . . 0.0 109.638 168.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.9 mt -131.27 123.86 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.617 0.767 . . . . 0.0 110.481 -170.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -81.77 143.23 31.95 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.336 1.454 . . . . 0.0 112.703 174.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -155.61 142.55 13.56 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.75 1.62 . . . . 0.0 110.508 169.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -63.75 142.92 85.04 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.723 2.282 . . . . 0.0 113.63 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.18 13.45 70.19 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.346 0.898 . . . . 0.0 115.346 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.27 156.58 46.41 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.262 1.425 . . . . 0.0 112.587 -177.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -70.19 153.37 95.31 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.652 0.781 . . . . 0.0 111.267 169.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.11 128.13 25.45 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.663 2.242 . . . . 0.0 112.502 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -83.33 123.36 29.56 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.814 0.846 . . . . 0.0 110.696 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 83.3 mt -85.79 135.59 33.67 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.529 0.732 . . . . 0.0 109.549 168.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -156.49 174.83 14.86 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.57 1.148 . . . . 0.0 111.486 174.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -120.2 118.34 30.24 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.245 1.018 . . . . 0.0 111.605 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.6 mt -83.69 111.28 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.241 1.417 . . . . 0.0 108.929 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -85.37 118.32 24.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.423 1.089 . . . . 0.0 109.629 169.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -68.56 -12.52 61.4 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -84.18 -23.65 30.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.515 1.126 . . . . 0.0 113.43 171.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -76.13 147.26 79.75 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 123.946 0.898 . . . . 0.0 111.929 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.84 144.14 63.83 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.974 2.45 . . . . 0.0 111.1 171.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.42 -32.08 72.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.994 -0.527 . . . . 0.0 112.173 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.6 m -58.4 -42.39 87.03 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.07 0.85 . . . . 0.0 112.555 174.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -41.61 71.93 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.897 -0.502 . . . . 0.0 111.958 175.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.09 -47.96 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.492 -0.755 . . . . 0.0 110.678 176.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.2 mt -59.82 -40.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.491 1.116 . . . . 0.0 110.671 177.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -58.99 -42.84 91.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.149 0.886 . . . . 0.0 112.514 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.59 -32.27 72.89 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.474 0.71 . . . . 0.0 112.469 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -68.57 -51.94 41.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 O-C-N 121.509 -0.744 . . . . 0.0 110.942 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 95.3 m -58.98 -44.1 91.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.785 0.834 . . . . 0.0 112.092 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -60.77 -29.38 69.39 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.218 1.007 . . . . 0.0 112.93 176.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.5 -23.52 66.87 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.241 0.924 . . . . 0.0 114.411 174.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -112.96 14.24 19.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.863 1.665 . . . . 0.0 113.261 171.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.3 m 55.33 25.96 8.13 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.914 1.686 . . . . 0.0 114.438 -175.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.82 119.49 17.12 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.813 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.47 165.03 25.88 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.388 1.075 . . . . 0.0 112.193 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.3 m120 55.23 53.87 9.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.326 1.45 . . . . 0.0 113.417 173.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -57.8 -17.57 16.67 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.244 1.018 . . . . 0.0 113.654 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -56.42 -20.46 19.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.835 1.654 . . . . 0.0 113.859 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -84.85 -15.92 43.06 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.639 1.576 . . . . 0.0 112.497 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -99.2 159.9 14.65 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.55 151.03 37.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.849 2.459 . . . . 0.0 109.81 171.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.3 mt -84.21 155.44 22.51 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 167.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -149.81 150.03 31.39 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.673 1.189 . . . . 0.0 110.044 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 . . . . . 0 N--CA 1.473 0.686 0 O-C-N 121.582 -0.698 . . . . 0.0 112.671 174.583 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 CA--C 1.54 0.565 0 CA-C-O 120.61 0.243 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.9 mm -79.7 138.12 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.546 0.738 . . . . 0.0 110.715 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.4 p -146.3 173.37 12.31 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.492 2.317 . . . . 0.0 109.223 -175.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -58.47 -21.27 50.93 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 174.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -90.12 -45.65 8.99 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.775 1.23 . . . . 0.0 112.599 170.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -78.11 -21.16 50.82 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.994 0.918 . . . . 0.0 113.286 -171.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -57.81 -26.17 61.6 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.205 1.002 . . . . 0.0 113.676 173.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -74.0 -17.28 61.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.695 1.198 . . . . 0.0 113.071 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -79.4 -14.42 58.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.188 0.995 . . . . 0.0 112.831 173.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.3 mt -71.33 132.01 33.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.397 1.079 . . . . 0.0 109.641 174.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -122.88 165.24 16.99 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.903 1.681 . . . . 0.0 111.568 173.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -60.12 121.8 12.81 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 121.721 -0.612 . . . . 0.0 110.944 178.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.66 63.92 Favored Glycine 0 CA--C 1.541 1.663 0 C-N-CA 125.302 1.429 . . . . 0.0 115.648 -174.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.5 m -63.77 134.14 54.76 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.64 1.72 . . . . 0.0 111.191 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.6 mt -91.02 121.83 41.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 121.93 0.871 . . . . 0.0 109.3 169.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.2 mt -111.85 177.6 4.59 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.337 2.255 . . . . 0.0 110.434 176.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -139.24 145.89 39.78 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.144 1.778 . . . . 0.0 110.251 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.7 tp -85.11 140.16 31.17 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.718 0.807 . . . . 0.0 109.759 170.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -155.3 150.84 27.31 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.877 0.871 . . . . 0.0 111.061 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.3 p -76.13 134.33 40.0 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.796 -1.19 . . . . 0.0 110.435 169.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.4 t . . . . . 0 CA--C 1.544 0.716 0 C-N-CA 123.676 0.79 . . . . 0.0 112.122 -175.8 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.3 mt . . . . . 0 N--CA 1.47 0.563 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.4 m -133.36 133.28 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.929 1.292 . . . . 0.0 112.091 -176.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -78.85 140.32 38.19 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.931 0.892 . . . . 0.0 111.376 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.51 157.64 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 125.82 1.648 . . . . 0.0 111.638 -177.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.16 28.49 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.622 1.169 . . . . 0.0 110.201 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.3 mt -106.22 127.29 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 124.352 1.061 . . . . 0.0 110.442 -171.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 67.5 mt-10 -89.24 149.53 23.05 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.038 1.335 . . . . 0.0 112.994 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -151.63 142.86 15.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 126.093 1.757 . . . . 0.0 110.053 170.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -60.91 137.19 70.77 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.545 2.163 . . . . 0.0 113.54 -175.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.67 12.49 74.1 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.454 0.941 . . . . 0.0 115.454 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.9 153.4 51.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.201 1.4 . . . . 0.0 112.765 -178.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -69.64 151.41 96.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.653 0.781 . . . . 0.0 111.33 170.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.1 130.32 33.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 113.321 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.16 111.79 18.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.202 1.401 . . . . 0.0 110.234 175.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.8 127.87 33.11 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.404 0.682 . . . . 0.0 109.575 169.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -155.01 177.86 10.84 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.134 0.974 . . . . 0.0 111.602 173.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -113.34 135.07 54.26 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.933 . . . . 0.0 112.202 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.2 mt -95.57 110.01 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.721 1.608 . . . . 0.0 108.245 171.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -87.9 114.93 24.98 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.185 1.394 . . . . 0.0 110.074 175.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -70.9 -10.28 59.34 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -85.38 -21.93 28.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.372 1.069 . . . . 0.0 113.225 170.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -81.01 148.73 65.05 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 124.371 1.069 . . . . 0.0 112.781 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.05 146.39 76.87 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.94 2.427 . . . . 0.0 110.931 169.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -61.67 -29.85 70.35 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.556 177.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -58.7 -46.06 88.15 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.209 0.913 . . . . 0.0 112.232 172.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.14 -40.68 98.27 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.605 -0.684 . . . . 0.0 112.09 176.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 90.3 mt -66.42 -48.97 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.473 0.709 . . . . 0.0 110.568 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.78 -36.88 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.389 1.076 . . . . 0.0 110.94 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.69 -40.5 92.46 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.791 0.836 . . . . 0.0 112.304 171.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -70.74 -25.81 63.09 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.355 1.062 . . . . 0.0 113.589 173.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.83 -61.93 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.865 1.211 . . . . 0.0 110.902 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.9 p -63.51 -33.79 76.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.777 0.831 . . . . 0.0 112.76 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.02 -28.61 69.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.905 0.882 . . . . 0.0 113.017 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.94 -23.24 69.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.242 0.925 . . . . 0.0 114.205 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -115.79 12.99 16.04 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.864 1.666 . . . . 0.0 113.172 173.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m 55.78 27.04 10.23 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.0 1.72 . . . . 0.0 114.589 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.53 130.8 37.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.212 1.405 . . . . 0.0 110.738 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.65 163.84 21.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.598 1.159 . . . . 0.0 113.789 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 52.61 68.81 0.77 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.686 1.994 . . . . 0.0 113.65 169.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -63.58 -17.77 63.19 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 -171.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -54.65 -32.95 59.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.505 1.522 . . . . 0.0 112.989 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -73.09 -21.29 60.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.388 1.075 . . . . 0.0 112.692 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -94.53 158.3 15.6 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.587 1.184 . . . . 0.0 114.159 -169.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.28 150.04 34.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.679 2.391 . . . . 0.0 109.725 173.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.3 mt -81.86 158.58 23.97 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 166.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -148.93 148.12 29.44 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.573 1.149 . . . . 0.0 110.243 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 N--CA 1.471 0.609 0 O-C-N 121.933 -0.48 . . . . 0.0 111.69 172.022 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.1 mm -76.07 136.54 24.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.764 0.792 . . . . 0.0 110.108 174.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.4 p -142.86 171.42 14.08 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.251 2.22 . . . . 0.0 108.768 -175.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -59.95 -18.15 43.25 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.361 -0.837 . . . . 0.0 113.131 176.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -89.59 -54.07 4.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.907 1.683 . . . . 0.0 111.391 168.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -69.6 -23.59 63.55 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.12 0.968 . . . . 0.0 113.126 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -55.46 -27.95 51.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -73.21 -18.06 61.29 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.334 1.054 . . . . 0.0 112.972 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -85.44 -13.97 47.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.668 1.187 . . . . 0.0 112.648 176.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.8 mt -66.54 137.85 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.657 1.183 . . . . 0.0 109.648 172.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -137.43 165.76 25.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.406 1.882 . . . . 0.0 111.828 -179.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.39 124.54 18.44 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.852 -0.53 . . . . 0.0 112.015 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.61 10.24 73.6 Favored Glycine 0 CA--C 1.539 1.532 0 C-N-CA 124.843 1.211 . . . . 0.0 115.514 -175.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 91.9 m -63.57 128.7 37.01 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.761 1.781 . . . . 0.0 110.792 175.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -86.82 123.23 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.6 mt -119.07 174.09 6.52 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.18 1.792 . . . . 0.0 110.957 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -139.2 135.5 34.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.544 1.938 . . . . 0.0 109.996 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.3 tp -79.47 135.9 36.78 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.071 0.548 . . . . 0.0 109.664 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.6 t -155.65 154.48 31.66 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.158 0.983 . . . . 0.0 110.216 -175.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.7 p -71.96 134.48 45.99 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.411 -1.431 . . . . 0.0 110.386 169.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t . . . . . 0 CA--C 1.537 0.465 0 C-N-CA 124.298 1.039 . . . . 0.0 110.614 174.532 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 120.857 0.361 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.0 m -129.55 126.41 63.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.585 1.554 . . . . 0.0 111.597 -178.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -74.13 140.23 45.08 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.981 0.912 . . . . 0.0 110.84 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 m -137.91 154.45 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.13 1.372 . . . . 0.0 111.83 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.08 38.8 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.946 1.298 . . . . 0.0 109.615 171.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.4 mt -110.18 123.95 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.725 0.81 . . . . 0.0 110.38 -170.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -88.57 153.32 21.22 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.886 1.274 . . . . 0.0 113.238 176.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -153.76 142.48 14.47 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 126.134 1.773 . . . . 0.0 109.658 169.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -60.12 133.94 53.09 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.51 2.14 . . . . 0.0 113.295 -175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.93 11.04 78.37 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 115.409 0.924 . . . . 0.0 115.409 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.49 151.56 51.46 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.975 1.387 . . . . 0.0 112.805 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -70.34 150.27 95.83 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.703 0.801 . . . . 0.0 111.371 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -61.09 130.18 31.53 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.421 2.08 . . . . 0.0 113.383 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -83.55 111.15 18.82 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.121 1.368 . . . . 0.0 110.124 175.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.43 132.47 39.68 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.674 0.79 . . . . 0.0 110.227 169.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -157.24 178.08 10.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.411 1.085 . . . . 0.0 111.688 177.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -122.21 131.25 53.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.492 1.117 . . . . 0.0 112.174 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 mt -100.19 109.79 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.636 1.575 . . . . 0.0 108.864 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -81.14 117.85 22.04 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 168.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -65.05 -13.89 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -86.22 -22.21 27.03 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.758 1.223 . . . . 0.0 114.087 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -86.13 149.56 50.34 Favored Pre-proline 0 N--CA 1.483 1.181 0 CA-C-N 119.778 1.172 . . . . 0.0 111.691 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.47 144.01 39.74 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.067 2.512 . . . . 0.0 112.337 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.4 mt -61.77 -31.73 71.95 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.445 0.698 . . . . 0.0 112.438 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.4 m -59.38 -42.4 91.61 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.168 0.894 . . . . 0.0 112.301 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.5 81.83 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.145 0.578 . . . . 0.0 111.902 175.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.81 -50.76 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.492 0.717 . . . . 0.0 110.581 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.5 mt -61.51 -38.54 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.073 -1.017 . . . . 0.0 110.865 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.3 -38.95 88.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.721 0.809 . . . . 0.0 112.552 171.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -72.25 -27.81 62.74 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.396 1.079 . . . . 0.0 113.488 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.41 -61.11 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.259 -0.9 . . . . 0.0 111.098 172.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 30.2 p -61.55 -33.45 73.86 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.582 0.753 . . . . 0.0 112.849 -171.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -60.27 -30.85 69.72 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.325 1.05 . . . . 0.0 112.893 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -23.13 67.93 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.378 0.989 . . . . 0.0 114.064 175.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -114.9 12.36 16.85 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.955 1.702 . . . . 0.0 113.307 173.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.3 p 55.93 22.67 5.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 127.284 2.233 . . . . 0.0 115.4 -176.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.62 125.99 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.083 1.353 . . . . 0.0 110.677 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.0 166.2 22.6 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.636 1.174 . . . . 0.0 113.4 -177.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 m120 54.06 63.13 2.29 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.984 1.714 . . . . 0.0 113.397 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -59.85 -25.44 65.03 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.208 -0.933 . . . . 0.0 113.482 -174.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -64.73 -15.84 62.08 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.852 1.261 . . . . 0.0 113.89 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -77.81 -20.87 52.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.161 -0.962 . . . . 0.0 112.407 168.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -94.38 160.81 14.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.903 1.281 . . . . 0.0 114.145 -169.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.43 157.38 43.76 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.829 2.451 . . . . 0.0 109.917 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 40.3 mt -87.41 151.69 22.86 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 167.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -139.22 144.4 38.46 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.813 1.245 . . . . 0.0 109.959 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 . . . . . 0 N--CA 1.471 0.58 0 C-N-CA 123.061 0.544 . . . . 0.0 112.377 176.914 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 . . . . . 0 N--CA 1.469 0.494 0 CA-C-O 121.051 0.453 . . . . 0.0 110.645 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -77.92 134.06 29.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.507 0.723 . . . . 0.0 109.673 173.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -139.31 169.55 17.56 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.97 1.708 . . . . 0.0 109.776 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -58.41 -21.29 50.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.099 0.96 . . . . 0.0 113.385 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -93.59 -47.48 6.8 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.295 1.438 . . . . 0.0 112.667 169.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -76.64 -17.25 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -54.29 -25.45 23.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.967 1.307 . . . . 0.0 114.231 171.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -67.54 -15.87 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.072 0.949 . . . . 0.0 113.512 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -79.17 -11.63 59.97 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.077 0.951 . . . . 0.0 113.426 171.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.0 mt -71.53 134.47 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 O-C-N 121.272 -0.893 . . . . 0.0 109.771 173.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -121.5 166.36 14.27 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.843 2.057 . . . . 0.0 111.629 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -57.57 124.03 17.64 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 121.855 -0.528 . . . . 0.0 110.738 173.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.51 11.59 68.54 Favored Glycine 0 CA--C 1.539 1.549 0 C-N-CA 125.11 1.338 . . . . 0.0 115.465 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.4 m -65.12 131.62 47.02 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 119.455 1.628 . . . . 0.0 111.599 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.3 mt -85.31 124.4 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 169.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.6 mt -119.46 174.65 6.25 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.845 2.058 . . . . 0.0 110.263 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -141.92 137.46 31.32 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.938 1.695 . . . . 0.0 110.181 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -77.09 139.84 40.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.956 0.902 . . . . 0.0 110.595 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.2 t -157.35 151.38 24.6 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.976 0.911 . . . . 0.0 111.242 -176.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.0 p -69.86 126.71 30.51 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.565 -1.335 . . . . 0.0 110.321 169.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 45.0 t . . . . . 0 CA--C 1.536 0.424 0 C-N-CA 125.121 1.369 . . . . 0.0 111.875 -177.769 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.6 mt . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -135.48 132.82 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.056 1.342 . . . . 0.0 112.136 -177.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -71.34 141.14 50.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.98 0.912 . . . . 0.0 111.396 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.3 m -141.81 155.14 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.942 1.297 . . . . 0.0 111.927 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.16 39.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.898 1.279 . . . . 0.0 109.792 171.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -109.18 125.23 66.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.922 0.889 . . . . 0.0 110.48 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -91.89 151.05 20.73 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.879 1.272 . . . . 0.0 113.381 177.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -151.35 143.38 16.08 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.069 1.748 . . . . 0.0 109.937 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -59.67 135.16 62.25 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.544 2.162 . . . . 0.0 113.505 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.58 11.32 76.92 Favored Glycine 0 CA--C 1.539 1.571 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -132.81 152.37 51.82 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.873 1.336 . . . . 0.0 112.866 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -70.44 152.18 95.51 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 123.689 0.796 . . . . 0.0 111.515 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.34 129.72 29.37 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.5 2.133 . . . . 0.0 113.265 -178.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -82.56 109.31 16.65 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.205 1.402 . . . . 0.0 110.05 174.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.8 131.9 40.06 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.723 0.809 . . . . 0.0 110.205 170.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -156.48 178.19 10.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.198 0.999 . . . . 0.0 112.067 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -118.58 122.45 42.65 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.701 1.2 . . . . 0.0 111.474 174.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.3 mt -84.78 108.46 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 124.425 1.09 . . . . 0.0 108.257 169.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -81.77 114.86 20.7 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.094 0.957 . . . . 0.0 108.825 169.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.01 -12.07 60.1 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -175.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -88.44 -23.06 23.39 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.761 1.224 . . . . 0.0 113.422 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -78.94 143.07 61.1 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.182 0.993 . . . . 0.0 111.295 174.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.52 144.41 66.75 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.089 2.526 . . . . 0.0 111.411 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -61.69 -30.06 70.5 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 118.78 -0.629 . . . . 0.0 112.615 178.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.3 p -59.98 -44.68 94.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.644 1.111 . . . . 0.0 112.402 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.72 -40.02 88.25 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.263 0.625 . . . . 0.0 112.055 174.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.7 -46.89 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.585 0.754 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.05 -37.02 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.581 1.153 . . . . 0.0 111.077 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -61.49 -38.62 87.97 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.743 0.701 . . . . 0.0 112.32 171.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -72.03 -25.13 61.69 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.329 1.052 . . . . 0.0 113.337 174.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 46.4 t -72.07 -57.6 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.277 0.944 . . . . 0.0 110.976 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.7 p -62.18 -33.76 75.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.865 0.866 . . . . 0.0 112.562 -169.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.17 -28.94 69.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.557 1.143 . . . . 0.0 113.029 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.11 -23.0 69.41 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.303 0.954 . . . . 0.0 114.088 175.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -117.73 10.28 13.28 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.052 1.741 . . . . 0.0 113.193 174.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.0 t 54.69 33.6 19.77 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.274 1.83 . . . . 0.0 113.865 -176.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -80.69 125.21 29.75 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.708 1.203 . . . . 0.0 110.489 179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.26 165.82 22.81 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.77 1.228 . . . . 0.0 113.245 -178.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 54.03 59.83 4.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.922 1.689 . . . . 0.0 113.569 172.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -60.24 -19.97 56.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -176.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -56.27 -29.27 60.9 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.237 1.415 . . . . 0.0 112.913 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -78.9 -19.75 51.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.015 0.926 . . . . 0.0 112.726 178.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -91.16 158.32 16.69 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -169.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.73 150.67 35.82 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.354 2.262 . . . . 0.0 110.086 172.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -82.54 153.45 25.53 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 167.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -145.4 150.36 36.4 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.826 1.25 . . . . 0.0 109.698 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 . . . . . 0 N--CA 1.474 0.747 0 O-C-N 121.487 -0.758 . . . . 0.0 111.146 173.267 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 CA--C 1.536 0.412 0 CA-C-O 121.445 0.64 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.4 mm -82.19 129.6 37.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 124.375 1.07 . . . . 0.0 109.283 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.7 p -142.53 167.19 22.68 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.619 1.568 . . . . 0.0 109.965 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -63.1 -10.01 12.91 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 120.979 -1.076 . . . . 0.0 113.451 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -105.68 -4.88 20.49 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.517 1.927 . . . . 0.0 114.406 173.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -130.22 -14.48 3.83 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -174.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.55 -18.47 59.38 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 178.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.47 -22.58 66.97 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.869 1.268 . . . . 0.0 112.959 174.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -75.15 -14.17 60.53 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.987 0.915 . . . . 0.0 113.184 177.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -73.77 132.64 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.472 1.109 . . . . 0.0 110.172 177.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -118.13 167.31 11.6 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.144 1.778 . . . . 0.0 111.886 170.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -59.41 127.27 31.23 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.633 -0.667 . . . . 0.0 110.979 172.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.77 10.35 69.96 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.041 1.305 . . . . 0.0 115.305 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.5 m -65.98 131.39 46.13 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.563 1.682 . . . . 0.0 111.084 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mt -89.74 125.02 42.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 172.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 89.5 mt -120.37 173.45 7.13 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.679 1.992 . . . . 0.0 110.578 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -139.83 146.88 39.93 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.793 1.637 . . . . 0.0 110.594 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.7 tp -85.22 138.98 32.0 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.219 1.008 . . . . 0.0 110.173 173.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.7 t -157.65 156.37 31.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.157 0.983 . . . . 0.0 110.871 -176.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.4 p -71.02 139.26 50.43 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.415 -1.428 . . . . 0.0 110.568 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.9 p . . . . . 0 CA--C 1.543 0.675 0 C-N-CA 126.011 1.724 . . . . 0.0 113.635 -171.041 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.6 mt . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 121.119 0.485 . . . . 0.0 111.416 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.5 m -133.67 135.36 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.033 1.733 . . . . 0.0 111.52 178.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.3 tttp -77.91 145.88 35.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.168 0.987 . . . . 0.0 110.873 172.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.9 m -141.73 155.5 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.777 1.631 . . . . 0.0 111.563 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.62 113.28 20.99 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.922 1.289 . . . . 0.0 109.992 174.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.7 mt -102.07 126.21 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.763 0.825 . . . . 0.0 110.839 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -82.9 143.1 30.96 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.722 1.609 . . . . 0.0 112.754 175.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -156.03 142.99 13.58 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.817 1.647 . . . . 0.0 110.429 170.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -63.24 143.9 90.55 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.699 2.266 . . . . 0.0 113.775 -174.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.84 71.42 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 115.476 0.95 . . . . 0.0 115.476 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -142.11 157.32 45.03 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.201 1.4 . . . . 0.0 112.641 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -70.21 154.1 94.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 123.762 0.825 . . . . 0.0 111.452 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.86 129.8 32.12 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.647 2.232 . . . . 0.0 112.746 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -81.15 109.63 15.88 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.095 0.958 . . . . 0.0 110.303 176.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.4 mt -76.91 126.16 30.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.48 0.712 . . . . 0.0 109.664 169.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.4 ptm -154.15 178.47 9.95 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.115 0.966 . . . . 0.0 111.766 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -115.96 137.72 51.85 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.401 1.081 . . . . 0.0 111.983 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.8 mt -105.33 114.03 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 C-N-CA 126.014 1.726 . . . . 0.0 108.717 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -87.53 119.93 28.33 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.887 0.875 . . . . 0.0 109.071 168.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -65.93 -15.07 62.64 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -83.95 -21.2 31.88 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.621 1.168 . . . . 0.0 113.977 172.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -80.2 146.97 63.81 Favored Pre-proline 0 N--CA 1.481 1.08 0 CA-C-N 119.386 0.994 . . . . 0.0 111.902 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.67 142.42 52.98 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.724 2.283 . . . . 0.0 111.06 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.5 mt -62.82 -29.61 70.86 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.298 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.6 p -60.83 -44.12 97.37 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.419 1.009 . . . . 0.0 112.576 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.87 87.63 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.574 0.625 . . . . 0.0 112.096 175.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.56 -48.38 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.345 0.658 . . . . 0.0 110.282 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -36.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.458 1.103 . . . . 0.0 111.213 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.68 -44.7 93.51 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.146 0.885 . . . . 0.0 112.066 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -66.51 -29.31 69.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.338 1.055 . . . . 0.0 113.074 174.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.92 -55.43 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.343 0.974 . . . . 0.0 110.514 169.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.07 -41.3 99.41 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.835 0.854 . . . . 0.0 112.182 -173.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.81 -27.29 68.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.634 0.774 . . . . 0.0 112.91 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.63 -23.58 67.15 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.425 1.012 . . . . 0.0 114.3 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -117.51 16.19 14.64 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.92 1.688 . . . . 0.0 113.144 172.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.1 m 55.59 26.42 9.14 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.92 1.688 . . . . 0.0 114.55 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.3 mt -72.46 125.41 27.35 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.113 1.365 . . . . 0.0 111.405 -178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.16 152.93 41.95 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.353 1.061 . . . . 0.0 112.352 176.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 49.27 68.11 0.78 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.458 1.903 . . . . 0.0 113.232 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -57.45 -17.25 12.29 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.971 1.308 . . . . 0.0 113.425 177.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -54.86 -27.93 46.21 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.705 1.602 . . . . 0.0 112.914 173.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -76.61 -18.37 58.65 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.938 0.895 . . . . 0.0 112.87 178.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -95.82 159.96 14.72 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -168.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.42 145.82 32.13 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.584 2.354 . . . . 0.0 109.563 172.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.46 154.96 28.53 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.456 0.646 . . . . 0.0 109.27 167.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -144.95 149.16 34.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 124.973 1.309 . . . . 0.0 110.019 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 . . . . . 0 N--CA 1.47 0.557 0 O-C-N 121.678 -0.639 . . . . 0.0 111.871 170.823 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.6 mm -74.59 135.45 27.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.169 0.588 . . . . 0.0 110.291 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 p -142.12 173.02 11.9 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.775 2.03 . . . . 0.0 109.436 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -57.82 -22.69 48.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -90.32 -48.94 6.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.824 1.25 . . . . 0.0 112.362 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -74.79 -20.13 59.92 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.162 0.985 . . . . 0.0 113.306 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -54.99 -26.53 37.5 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.423 1.089 . . . . 0.0 113.843 171.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -72.6 -15.92 61.73 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.317 1.047 . . . . 0.0 113.376 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.22 -13.04 60.02 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.162 0.985 . . . . 0.0 112.894 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.0 mt -70.52 129.99 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.98 0.912 . . . . 0.0 109.65 174.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -111.47 165.29 12.11 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.247 1.819 . . . . 0.0 111.867 170.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -61.29 125.5 23.97 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.604 -0.685 . . . . 0.0 110.929 174.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.67 13.71 69.44 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.039 1.304 . . . . 0.0 115.392 -174.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.0 m -64.55 131.0 45.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 119.763 1.782 . . . . 0.0 111.69 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.6 mt -80.68 121.32 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 168.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -113.91 177.96 4.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.333 1.853 . . . . 0.0 110.455 176.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -143.18 136.27 27.98 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 126.813 2.045 . . . . 0.0 110.285 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.4 tp -82.11 137.65 34.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.274 0.63 . . . . 0.0 109.734 169.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.1 t -155.87 154.63 31.57 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.121 0.968 . . . . 0.0 110.241 -177.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.5 p -70.03 141.0 52.94 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.547 -1.346 . . . . 0.0 110.571 170.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.2 t . . . . . 0 CA--C 1.542 0.656 0 C-N-CA 125.767 1.627 . . . . 0.0 113.164 -172.982 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 19.6 mt . . . . . 0 N--CA 1.47 0.572 0 CA-C-O 121.14 0.495 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.41 129.83 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 126.27 1.828 . . . . 0.0 110.867 175.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -73.61 143.32 46.41 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.956 0.902 . . . . 0.0 110.397 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.36 151.36 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.196 1.398 . . . . 0.0 111.171 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.09 129.01 56.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.526 1.13 . . . . 0.0 109.95 171.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -118.44 122.58 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.865 0.866 . . . . 0.0 110.821 -169.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -81.73 141.54 33.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.276 1.43 . . . . 0.0 112.86 175.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . 0.415 ' CD2' ' HD2' ' A' ' 15' ' ' PRO . 68.6 t-105 -158.84 139.53 9.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.677 1.991 . . . . 0.0 109.626 169.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.415 ' HD2' ' CD2' ' A' ' 14' ' ' TRP . 59.2 Cg_endo -68.08 150.59 77.49 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.131 2.554 . . . . 0.0 113.204 -173.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 73.46 9.96 78.55 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.188 0.899 . . . . 0.0 115.151 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.12 160.5 42.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.635 1.574 . . . . 0.0 112.248 -178.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -71.28 155.94 92.32 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.008 0.923 . . . . 0.0 111.743 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.36 126.95 22.24 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.871 2.381 . . . . 0.0 112.312 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -83.76 115.77 22.38 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.101 0.96 . . . . 0.0 110.973 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.48 130.93 35.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.247 0.619 . . . . 0.0 109.808 168.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -151.16 173.66 14.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.537 1.135 . . . . 0.0 110.998 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -126.79 114.23 17.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.21 1.004 . . . . 0.0 111.513 -173.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.7 mt -86.4 116.02 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 125.476 1.51 . . . . 0.0 109.744 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -82.51 117.84 22.81 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 167.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.0 -9.64 41.13 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -91.34 -19.89 22.44 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 170.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -87.16 148.58 45.32 Favored Pre-proline 0 N--CA 1.485 1.309 0 CA-C-N 120.225 1.375 . . . . 0.0 111.967 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.57 146.92 56.46 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.415 2.743 . . . . 0.0 112.577 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.84 -30.14 71.26 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 118.245 -0.883 . . . . 0.0 113.103 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.2 t -58.92 -45.23 90.83 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.991 1.269 . . . . 0.0 111.61 173.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.23 95.33 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.765 -0.584 . . . . 0.0 112.26 175.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 60.6 mt -60.9 -51.91 67.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.683 0.793 . . . . 0.0 111.251 175.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.4 mt -61.57 -39.83 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 123.943 0.897 . . . . 0.0 110.017 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -58.57 -43.61 89.45 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.758 0.708 . . . . 0.0 112.368 171.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -69.91 -26.33 64.11 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.565 1.146 . . . . 0.0 112.903 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.6 t -71.0 -61.39 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.919 0.888 . . . . 0.0 110.093 169.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -55.37 -39.2 69.82 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.56 1.544 . . . . 0.0 113.764 -173.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.87 -29.77 68.53 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.56 -29.79 72.94 Favored Glycine 0 CA--C 1.534 1.257 0 O-C-N 121.291 -0.881 . . . . 0.0 113.897 177.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -99.22 14.03 30.91 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.192 1.397 . . . . 0.0 112.883 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p 57.67 20.68 6.56 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.467 2.307 . . . . 0.0 115.322 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -72.39 113.42 9.42 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.877 1.271 . . . . 0.0 110.889 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.18 162.99 28.39 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.308 1.043 . . . . 0.0 112.207 174.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.5 m120 54.16 65.26 1.56 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.724 1.609 . . . . 0.0 112.777 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 32.3 p-80 -62.77 -14.34 43.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.353 1.061 . . . . 0.0 113.333 -177.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -54.57 -29.48 51.38 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.274 1.83 . . . . 0.0 113.407 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -74.98 -21.22 59.28 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.545 1.138 . . . . 0.0 112.86 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -98.24 160.01 14.57 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -168.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.24 156.42 39.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.305 2.242 . . . . 0.0 110.137 169.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.7 mt -80.32 154.53 27.73 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 167.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -142.17 144.8 33.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.655 1.182 . . . . 0.0 110.372 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 178.134 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 . . . . . 0 CA--C 1.537 0.446 0 CA-C-O 121.0 0.429 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mm -80.14 135.65 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.849 0.859 . . . . 0.0 110.409 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -143.78 168.93 18.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.15 2.18 . . . . 0.0 108.86 -177.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -61.3 -15.55 36.63 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.367 -0.833 . . . . 0.0 113.229 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -87.99 -50.4 6.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.321 1.448 . . . . 0.0 112.082 168.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -77.22 -19.63 56.41 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.992 1.317 . . . . 0.0 114.375 -168.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -58.32 -17.91 23.39 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -66.23 -19.21 65.76 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 173.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -75.43 -16.14 60.37 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.134 0.974 . . . . 0.0 113.113 173.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.9 mt -75.67 128.65 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 123.967 0.907 . . . . 0.0 109.688 177.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -120.6 168.38 11.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.255 1.822 . . . . 0.0 111.842 171.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -61.16 121.96 13.84 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.613 -0.679 . . . . 0.0 111.312 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.23 10.19 62.61 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.438 1.494 . . . . 0.0 115.594 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.0 m -64.81 131.33 46.5 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 119.692 1.746 . . . . 0.0 111.861 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 43.7 mt -87.2 125.9 40.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.85 0.86 . . . . 0.0 109.784 169.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.1 mt -124.79 176.75 6.39 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.877 2.471 . . . . 0.0 109.924 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt85 -136.61 149.07 47.81 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.846 1.259 . . . . 0.0 110.814 168.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.2 tp -82.98 138.81 33.63 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.52 156.53 32.19 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.165 0.986 . . . . 0.0 110.67 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 26.8 p -70.63 132.44 45.45 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.62 -1.3 . . . . 0.0 110.418 169.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 p . . . . . 0 CA--C 1.545 0.764 0 C-N-CA 125.339 1.456 . . . . 0.0 112.498 -176.753 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.0 mt . . . . . 0 N--CA 1.469 0.51 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 10.3 m -129.79 127.47 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.19 1.396 . . . . 0.0 111.594 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -75.83 141.56 42.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.006 0.922 . . . . 0.0 111.03 175.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -140.68 156.83 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.498 1.519 . . . . 0.0 111.936 -176.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.28 116.24 26.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.789 1.235 . . . . 0.0 109.945 170.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.71 126.1 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 124.303 1.041 . . . . 0.0 110.568 -171.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -84.56 146.92 27.29 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.262 1.425 . . . . 0.0 113.147 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -153.34 142.18 14.43 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 125.941 1.696 . . . . 0.0 110.167 169.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -62.07 138.67 74.33 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.66 2.24 . . . . 0.0 113.592 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.73 13.21 71.58 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.355 0.902 . . . . 0.0 115.355 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.8 154.22 50.6 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.263 1.425 . . . . 0.0 112.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -68.56 148.35 98.1 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 123.522 0.729 . . . . 0.0 111.059 170.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.34 129.91 33.5 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.548 2.165 . . . . 0.0 113.064 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -81.08 111.62 17.7 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.64 1.176 . . . . 0.0 110.347 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -77.03 127.51 32.81 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.328 0.651 . . . . 0.0 109.651 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -154.86 178.18 10.45 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.014 0.925 . . . . 0.0 111.833 173.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -115.8 136.44 53.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.453 1.101 . . . . 0.0 111.924 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.0 mt -105.1 107.43 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 125.794 1.637 . . . . 0.0 108.225 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -78.34 117.04 19.2 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 168.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -67.07 -13.39 61.88 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -87.36 -21.96 25.35 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.188 0.995 . . . . 0.0 113.681 173.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -75.99 148.35 81.49 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 124.469 1.108 . . . . 0.0 111.852 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.02 139.34 42.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.978 2.452 . . . . 0.0 111.04 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.4 mt -61.44 -31.13 71.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.35 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.7 t -60.02 -44.51 94.56 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.56 1.073 . . . . 0.0 112.291 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -39.84 93.5 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.659 -0.651 . . . . 0.0 112.026 175.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.5 mt -65.03 -46.49 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.166 0.586 . . . . 0.0 110.619 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.1 mt -60.26 -38.2 76.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.658 1.183 . . . . 0.0 111.138 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -61.69 -40.15 93.97 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.4 0.68 . . . . 0.0 112.316 172.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -69.31 -25.66 64.34 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.396 1.078 . . . . 0.0 113.167 173.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.35 -58.99 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.438 1.017 . . . . 0.0 110.564 169.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.3 p -65.08 -35.05 79.92 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.238 0.615 . . . . 0.0 112.348 -169.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.53 -29.0 68.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.055 0.942 . . . . 0.0 112.922 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -22.98 68.47 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.421 1.01 . . . . 0.0 114.263 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -115.48 10.71 15.78 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.022 1.729 . . . . 0.0 113.053 172.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.1 t 54.96 31.1 15.29 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.049 1.74 . . . . 0.0 114.169 -175.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.41 125.42 29.51 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.707 1.203 . . . . 0.0 109.908 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.83 159.23 30.24 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 113.586 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 51.6 75.78 0.19 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.081 2.153 . . . . 0.0 113.325 170.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -62.33 -17.82 59.81 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.485 1.114 . . . . 0.0 113.661 -173.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -55.31 -30.88 61.07 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.224 1.41 . . . . 0.0 112.68 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -73.55 -23.49 59.98 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.155 0.582 . . . . 0.0 112.22 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -94.85 158.03 15.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.801 1.24 . . . . 0.0 114.331 -169.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.71 148.41 35.66 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.731 2.013 . . . . 0.0 109.748 169.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.29 148.33 35.76 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 167.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -141.39 153.99 45.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.344 1.458 . . . . 0.0 109.375 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 . . . . . 0 CA--C 1.535 0.401 0 O-C-N 121.314 -0.866 . . . . 0.0 112.427 171.77 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 N--CA 1.471 0.594 0 CA-C-O 121.027 0.441 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.82 131.15 34.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.096 0.958 . . . . 0.0 110.238 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -146.9 169.48 19.07 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.155 1.782 . . . . 0.0 110.102 -176.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -60.03 -18.0 43.03 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.734 -1.229 . . . . 0.0 113.458 172.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -96.0 -8.06 34.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.988 1.715 . . . . 0.0 114.296 175.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -133.69 -13.28 2.58 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 -172.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -59.95 -23.31 63.46 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 120.581 -1.324 . . . . 0.0 114.105 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -61.78 -22.69 65.65 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.394 1.478 . . . . 0.0 113.279 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -73.75 -19.55 60.75 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.641 0.777 . . . . 0.0 112.863 177.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 51.3 mt -68.76 132.71 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.97 0.908 . . . . 0.0 109.603 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -135.48 165.51 25.34 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.651 1.98 . . . . 0.0 111.882 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -57.62 116.04 3.15 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.332 0.653 . . . . 0.0 111.362 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.15 11.58 56.03 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.59 1.567 . . . . 0.0 115.568 -176.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.9 m -65.85 133.12 50.28 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.606 1.703 . . . . 0.0 111.781 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -85.19 121.97 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 170.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -118.7 -179.89 3.94 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.734 2.013 . . . . 0.0 110.873 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -148.55 137.45 21.6 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 127.331 2.252 . . . . 0.0 110.256 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 tp -85.27 137.88 32.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.754 0.821 . . . . 0.0 109.993 169.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.2 t -157.19 151.86 25.5 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.812 0.845 . . . . 0.0 110.917 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.3 p -71.03 132.63 45.43 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.988 -1.07 . . . . 0.0 110.298 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.9 p . . . . . 0 CA--C 1.541 0.616 0 C-N-CA 125.462 1.505 . . . . 0.0 114.199 -169.292 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.5 mt . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 m -129.44 132.17 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.937 1.295 . . . . 0.0 112.01 -177.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -69.15 146.42 52.49 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.761 0.824 . . . . 0.0 110.756 170.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m -143.69 151.58 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.408 1.483 . . . . 0.0 111.521 176.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.87 116.75 28.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.665 1.186 . . . . 0.0 109.854 173.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.7 mt -106.7 123.96 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.907 0.883 . . . . 0.0 110.823 -169.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -82.7 144.69 30.06 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.236 1.414 . . . . 0.0 112.933 174.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -154.83 143.44 14.67 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 126.003 1.721 . . . . 0.0 110.079 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -63.02 143.21 90.46 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.605 2.203 . . . . 0.0 113.789 -173.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.5 12.27 73.2 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 178.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.91 155.79 45.5 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.181 1.392 . . . . 0.0 112.702 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -69.47 152.86 96.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 123.803 0.841 . . . . 0.0 111.371 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.99 128.9 29.52 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.596 2.198 . . . . 0.0 113.17 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -78.29 111.32 14.14 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.623 1.169 . . . . 0.0 110.148 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.3 127.67 32.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.316 0.646 . . . . 0.0 109.584 169.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.4 ptm -152.63 -178.52 6.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.035 0.934 . . . . 0.0 111.67 172.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -122.44 129.64 52.26 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.49 1.116 . . . . 0.0 111.572 178.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.2 mt -96.26 112.87 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 C-N-CA 125.311 1.444 . . . . 0.0 108.664 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.99 120.47 26.15 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 167.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -64.92 -11.09 34.28 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -87.22 -21.9 25.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.944 1.298 . . . . 0.0 114.345 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -77.97 141.87 63.88 Favored Pre-proline 0 N--CA 1.483 1.191 0 CA-C-N 119.831 1.196 . . . . 0.0 111.513 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.19 144.22 56.32 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.333 2.688 . . . . 0.0 111.543 177.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.1 mt -63.72 -29.97 71.13 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.071 -0.966 . . . . 0.0 113.097 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.0 t -61.13 -44.82 96.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.397 1.453 . . . . 0.0 111.898 174.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.11 95.52 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.567 -0.708 . . . . 0.0 112.194 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.12 -50.41 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.399 0.679 . . . . 0.0 110.502 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.01 -35.66 69.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.299 1.04 . . . . 0.0 110.946 -179.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.02 -43.33 95.34 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.041 0.837 . . . . 0.0 112.081 170.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -68.74 -29.69 68.16 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.732 1.213 . . . . 0.0 113.121 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.16 -53.66 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 121.292 -0.88 . . . . 0.0 110.155 169.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.0 m -61.4 -43.73 98.37 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.161 0.984 . . . . 0.0 111.986 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -60.34 -29.72 69.07 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.098 0.959 . . . . 0.0 112.847 175.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.32 -23.58 62.45 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.395 0.998 . . . . 0.0 114.436 173.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.71 16.86 14.45 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.97 1.708 . . . . 0.0 113.25 171.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.0 p 56.33 21.02 5.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.281 2.232 . . . . 0.0 115.536 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -68.41 123.92 22.1 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.447 1.499 . . . . 0.0 111.423 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.89 158.73 31.72 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.445 1.098 . . . . 0.0 112.365 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 50.52 68.41 0.77 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.491 1.916 . . . . 0.0 112.998 173.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -62.2 -15.72 48.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.558 1.143 . . . . 0.0 113.158 -177.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -55.99 -26.92 50.59 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.754 1.622 . . . . 0.0 113.197 176.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -77.77 -15.9 58.77 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -98.18 157.65 16.03 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -168.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.65 149.24 35.35 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 127.297 2.239 . . . . 0.0 109.53 169.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -78.39 157.16 29.14 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -145.85 147.82 32.22 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.792 1.237 . . . . 0.0 110.157 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 . . . . . 0 N--CA 1.475 0.786 0 O-C-N 121.629 -0.669 . . . . 0.0 110.906 173.37 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.103 0.478 . . . . 0.0 110.005 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.1 mm -80.6 136.64 22.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.115 0.966 . . . . 0.0 110.083 175.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.0 p -144.43 169.51 17.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.236 2.214 . . . . 0.0 108.553 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -62.19 -11.78 16.41 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 177.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.76 -44.97 6.85 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.352 1.461 . . . . 0.0 112.509 168.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -76.25 -21.64 56.11 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.486 1.114 . . . . 0.0 113.509 -172.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -57.15 -22.23 38.63 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 176.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -66.86 -18.51 65.41 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.401 1.081 . . . . 0.0 113.377 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -79.83 -11.26 59.83 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.288 1.035 . . . . 0.0 113.452 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.4 mt -76.14 133.03 31.99 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.311 1.044 . . . . 0.0 109.651 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.75 166.89 15.39 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.724 2.01 . . . . 0.0 111.804 173.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -60.65 118.89 7.13 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.823 -0.548 . . . . 0.0 111.41 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.16 14.34 56.17 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 125.293 1.425 . . . . 0.0 115.436 -175.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -65.33 130.62 43.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.77 1.785 . . . . 0.0 111.28 177.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mt -84.29 121.92 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 170.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -117.88 174.62 6.08 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.255 1.822 . . . . 0.0 110.671 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -141.92 133.84 27.33 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 126.239 1.816 . . . . 0.0 109.976 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 tp -79.47 136.8 37.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.194 0.598 . . . . 0.0 110.138 170.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.3 t -157.53 151.0 23.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.421 1.088 . . . . 0.0 110.11 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.9 p -72.0 138.57 48.06 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.493 -1.38 . . . . 0.0 110.388 169.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p . . . . . 0 CA--C 1.544 0.712 0 C-N-CA 123.954 0.902 . . . . 0.0 112.234 -175.56 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.1 mt . . . . . 0 N--CA 1.47 0.57 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 m -129.02 123.3 58.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.484 1.114 . . . . 0.0 112.745 -173.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -72.86 137.72 45.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.37 1.468 . . . . 0.0 111.261 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.7 m -139.34 157.01 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.511 1.524 . . . . 0.0 111.956 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.54 118.47 32.73 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.817 1.247 . . . . 0.0 109.837 171.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.5 mt -106.03 123.97 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.805 0.842 . . . . 0.0 110.882 -171.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -85.53 143.57 28.43 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.062 1.745 . . . . 0.0 113.025 176.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -156.46 142.09 12.7 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.086 1.754 . . . . 0.0 110.1 169.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -59.12 145.88 96.25 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.999 2.466 . . . . 0.0 114.493 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.1 11.46 74.89 Favored Glycine 0 CA--C 1.539 1.56 0 N-CA-C 115.607 1.003 . . . . 0.0 115.607 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -144.72 158.6 43.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.104 1.361 . . . . 0.0 112.695 -177.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -70.65 155.42 93.42 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.012 0.925 . . . . 0.0 111.662 170.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -60.65 130.18 32.31 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.653 2.235 . . . . 0.0 112.732 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -82.74 108.74 16.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.354 1.061 . . . . 0.0 110.453 176.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.7 mt -76.4 128.03 34.03 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 110.17 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -155.3 175.37 13.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.411 1.084 . . . . 0.0 111.638 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -122.71 118.32 27.81 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.383 1.073 . . . . 0.0 111.584 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.8 mt -83.79 110.54 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 125.227 1.411 . . . . 0.0 108.848 175.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -81.95 116.48 21.6 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 169.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.68 -12.71 55.92 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.0 -26.63 26.97 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.35 0.977 . . . . 0.0 113.489 171.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -77.45 142.48 67.06 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.02 0.928 . . . . 0.0 111.396 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.22 143.15 63.48 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.12 2.547 . . . . 0.0 111.296 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.2 mt -60.69 -31.39 70.64 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.442 178.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.8 p -59.18 -45.4 91.12 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.597 1.09 . . . . 0.0 112.45 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.77 89.48 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.178 0.591 . . . . 0.0 112.109 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.73 -47.54 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.647 0.779 . . . . 0.0 110.843 177.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.52 -37.73 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.589 1.156 . . . . 0.0 110.761 178.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -62.93 -38.47 91.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 172.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -71.02 -23.94 62.27 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.262 1.025 . . . . 0.0 113.074 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 73.2 t -73.14 -62.32 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 O-C-N 121.107 -0.996 . . . . 0.0 111.005 169.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.8 p -59.74 -30.98 69.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.94 1.296 . . . . 0.0 113.652 -169.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.85 -28.38 67.47 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.573 1.149 . . . . 0.0 113.346 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.68 -26.08 74.83 Favored Glycine 0 CA--C 1.534 1.232 0 O-C-N 121.332 -0.855 . . . . 0.0 114.011 177.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.0 m0 -107.67 11.09 28.77 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.668 1.587 . . . . 0.0 112.84 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.8 m 55.41 29.23 12.77 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.157 1.783 . . . . 0.0 114.065 -176.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -80.51 121.01 25.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.602 1.161 . . . . 0.0 110.332 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.7 165.85 23.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.78 1.232 . . . . 0.0 113.214 -178.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 54.15 63.75 2.07 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.037 1.735 . . . . 0.0 113.417 173.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -59.77 -21.8 61.26 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.958 0.903 . . . . 0.0 113.35 -176.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -55.95 -28.92 59.14 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.211 1.405 . . . . 0.0 113.127 172.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -77.77 -16.81 58.12 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.785 0.834 . . . . 0.0 112.624 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -96.99 159.64 14.79 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -169.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.27 156.35 43.31 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.152 2.581 . . . . 0.0 109.78 171.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.0 mt -89.5 156.02 18.91 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 166.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -148.25 147.34 29.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.979 0.912 . . . . 0.0 110.998 -177.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 52.2 m-70 . . . . . 0 N--CA 1.472 0.626 0 C-N-CA 123.336 0.654 . . . . 0.0 112.036 174.987 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 . . . . . 0 CA--C 1.539 0.519 0 CA-C-O 121.189 0.519 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mm -82.14 130.22 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 123.988 0.915 . . . . 0.0 109.545 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.5 p -143.69 166.77 23.94 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.786 1.634 . . . . 0.0 109.78 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.57 -13.16 27.97 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.853 -1.154 . . . . 0.0 113.345 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -97.91 -13.59 21.12 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.123 1.769 . . . . 0.0 114.417 173.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -126.3 -11.74 6.31 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -60.74 -18.88 57.38 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -62.4 -22.13 65.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.807 1.243 . . . . 0.0 113.112 174.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -75.02 -13.15 60.47 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.062 0.945 . . . . 0.0 113.357 177.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 65.3 mt -73.37 134.48 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.321 1.049 . . . . 0.0 110.079 175.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -126.85 166.38 17.57 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.227 1.811 . . . . 0.0 111.442 174.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -56.92 125.09 20.96 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.761 -0.587 . . . . 0.0 111.321 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.7 9.29 68.89 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.238 1.399 . . . . 0.0 115.343 -176.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 99.0 m -66.0 130.07 41.99 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.498 1.649 . . . . 0.0 111.255 177.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.8 mt -87.0 124.77 40.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 170.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.4 mt -118.21 172.46 7.42 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.239 1.815 . . . . 0.0 110.723 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.7 ttt-85 -132.11 140.38 48.79 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 126.745 2.018 . . . . 0.0 110.049 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.96 140.19 38.07 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 167.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -158.25 152.84 24.69 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.308 -0.87 . . . . 0.0 111.028 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.1 p -73.6 135.15 43.83 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.568 -1.332 . . . . 0.0 110.856 170.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 126.434 1.893 . . . . 0.0 114.421 -168.71 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 ttp -150.32 136.66 10.86 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 125.239 1.415 . . . . 0.0 110.804 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -70.73 162.87 41.05 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.146 2.564 . . . . 0.0 112.911 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.0 153.35 52.16 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 123.535 2.823 . . . . 0.0 113.448 173.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -66.0 149.12 86.29 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.337 2.692 . . . . 0.0 112.521 177.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -71.67 155.37 40.57 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.145 0.978 . . . . 0.0 113.105 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.1 p-10 -92.28 19.31 7.17 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.238 1.815 . . . . 0.0 113.664 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 54.1 mt -64.35 138.13 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.504 1.521 . . . . 0.0 109.685 171.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.6 m -131.94 129.9 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.029 1.331 . . . . 0.0 112.399 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -76.35 141.61 41.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.123 0.969 . . . . 0.0 111.264 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.87 156.11 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.753 1.621 . . . . 0.0 111.512 -177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.89 121.58 41.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.669 1.188 . . . . 0.0 109.786 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.9 mt -109.68 125.42 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.224 1.01 . . . . 0.0 110.474 -170.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -81.55 148.28 29.23 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.167 1.387 . . . . 0.0 113.375 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -155.89 142.9 13.6 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.108 1.763 . . . . 0.0 110.093 168.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -60.56 140.14 89.67 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.756 2.304 . . . . 0.0 113.823 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.58 12.84 70.69 Favored Glycine 0 CA--C 1.539 1.577 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.96 153.58 48.2 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.173 1.389 . . . . 0.0 112.611 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -69.59 150.07 96.86 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.492 0.717 . . . . 0.0 110.936 169.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -59.66 131.07 38.11 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.39 2.06 . . . . 0.0 113.332 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -80.05 114.51 19.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.721 1.209 . . . . 0.0 110.429 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.36 129.96 35.59 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.282 0.633 . . . . 0.0 109.706 169.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 23.9 ptm -154.68 177.13 11.58 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.117 0.967 . . . . 0.0 111.689 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -119.3 124.03 45.67 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.23 1.012 . . . . 0.0 111.211 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.7 mt -90.72 110.06 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 125.531 1.532 . . . . 0.0 108.575 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.1 t0 -83.33 118.3 23.59 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.731 0.813 . . . . 0.0 109.774 169.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -65.47 -12.33 51.59 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.12 -25.19 29.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.597 1.089 . . . . 0.0 113.716 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -78.29 148.76 74.82 Favored Pre-proline 0 N--CA 1.48 1.042 0 C-N-CA 124.455 1.102 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.44 141.75 47.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.888 2.392 . . . . 0.0 110.963 173.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -61.49 -30.96 70.94 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 123.107 0.563 . . . . 0.0 112.293 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -59.45 -43.96 93.06 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.038 0.836 . . . . 0.0 112.53 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.76 81.4 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.944 -0.472 . . . . 0.0 111.985 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.06 -48.43 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.33 0.652 . . . . 0.0 110.432 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.39 -38.87 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.619 1.168 . . . . 0.0 111.051 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -59.68 -40.19 87.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.502 0.721 . . . . 0.0 112.174 171.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -71.72 -24.76 61.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.454 1.102 . . . . 0.0 113.618 174.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 23.1 t -68.93 -62.22 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.727 1.149 . . . . 0.0 110.615 169.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.1 p -64.66 -33.64 76.43 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.81 0.844 . . . . 0.0 112.659 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.76 -28.67 68.9 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.827 0.851 . . . . 0.0 112.873 172.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.79 -23.16 68.92 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.333 0.968 . . . . 0.0 114.163 174.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -114.18 12.07 17.68 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.94 1.696 . . . . 0.0 113.296 172.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.0 m 54.88 27.68 9.39 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.982 1.713 . . . . 0.0 114.479 -175.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.4 mt -76.81 127.49 32.85 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.133 1.373 . . . . 0.0 110.57 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.52 164.17 25.64 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.686 1.194 . . . . 0.0 113.462 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 53.64 68.23 0.88 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.313 1.845 . . . . 0.0 113.64 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -60.73 -21.95 63.49 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.072 -1.017 . . . . 0.0 113.496 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -54.98 -28.32 50.81 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 112.923 171.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -77.3 -18.33 57.6 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.399 1.08 . . . . 0.0 113.027 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -98.07 158.74 15.37 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -168.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.03 154.51 42.59 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.702 2.401 . . . . 0.0 110.061 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -87.3 150.49 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.42 0.629 . . . . 0.0 109.851 168.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -137.14 143.44 42.47 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.411 1.884 . . . . 0.0 109.181 -176.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -75.59 125.81 29.76 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.225 0.61 . . . . 0.0 110.543 171.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -98.2 -31.32 12.15 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.775 0.83 . . . . 0.0 113.205 178.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -70.32 -39.89 74.49 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -176.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.6 t -162.21 176.04 11.04 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.801 1.64 . . . . 0.0 111.111 -178.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.6 p 62.49 -34.21 0.11 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 129.659 3.184 . . . . 0.0 118.506 174.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . 0.286 0.7 OUTLIER 48.85 32.4 3.71 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 126.616 1.966 . . . . 0.0 114.434 -169.728 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -76.95 122.96 25.61 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.696 0.799 . . . . 0.0 111.771 171.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -61.58 142.22 57.25 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.875 -0.515 . . . . 0.0 110.014 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 mm -76.32 135.65 26.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.664 0.745 . . . . 0.0 110.797 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.4 p -143.3 173.7 11.37 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.586 2.355 . . . . 0.0 109.136 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -57.08 -22.53 40.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -90.0 -52.89 4.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.436 . . . . 0.0 112.161 169.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.7 -17.04 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -171.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.31 -28.08 40.0 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.521 1.128 . . . . 0.0 113.665 169.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -72.48 -15.93 61.8 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.203 1.001 . . . . 0.0 113.442 177.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.83 -14.14 59.42 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.902 0.881 . . . . 0.0 112.945 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.3 mt -74.8 134.0 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 124.556 1.143 . . . . 0.0 110.016 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 168.02 14.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.713 2.005 . . . . 0.0 112.28 174.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.76 123.76 18.43 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.69 -0.631 . . . . 0.0 111.176 174.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.53 34.15 36.57 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.1 0.857 . . . . 0.0 114.084 -172.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.0 m -79.06 132.45 36.62 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.168 1.484 . . . . 0.0 110.716 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mt -86.44 113.21 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.6 mt -109.0 177.18 4.84 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.123 1.769 . . . . 0.0 110.869 176.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.6 ttt85 -145.64 137.93 25.6 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.56 1.944 . . . . 0.0 110.294 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 tp -82.69 136.98 34.59 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.557 0.743 . . . . 0.0 110.06 171.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.8 t -156.84 152.32 26.7 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.049 0.94 . . . . 0.0 110.834 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.7 p -72.14 135.29 46.14 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.714 -1.241 . . . . 0.0 110.976 172.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 48.1 t -69.12 142.97 93.55 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 125.322 1.449 . . . . 0.0 113.554 -170.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -58.86 -17.59 37.55 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.472 2.781 . . . . 0.0 114.214 168.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.51 -14.46 58.86 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.041 1.336 . . . . 0.0 114.532 174.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.6 tm0? -68.02 -35.56 78.49 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -169.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.38 134.43 52.52 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.718 1.207 . . . . 0.0 112.467 175.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -153.33 162.25 41.49 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.482 1.513 . . . . 0.0 111.602 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -69.28 127.44 33.08 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.582 0.753 . . . . 0.0 111.47 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -82.97 49.0 1.44 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.406 1.482 . . . . 0.0 112.853 -174.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 68.0 mt -70.08 -35.4 74.17 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.733 1.213 . . . . 0.0 113.817 -172.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -147.66 164.83 32.28 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.945 1.698 . . . . 0.0 112.156 -172.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -144.57 141.03 29.16 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.429 1.492 . . . . 0.0 110.915 175.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 35.8 ttp-105 -79.43 64.25 4.27 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.973 1.309 . . . . 0.0 112.192 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 43.7 pt -64.73 -9.72 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.525 1.53 . . . . 0.0 114.388 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -62.44 -12.59 22.68 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.352 1.461 . . . . 0.0 113.76 177.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 89.1 p -63.37 -20.95 65.97 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.399 1.08 . . . . 0.0 113.558 170.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 89.3 p -68.19 -39.14 82.58 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.107 0.963 . . . . 0.0 113.028 176.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.2 t -164.99 133.53 3.34 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.837 1.655 . . . . 0.0 111.109 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 tpt -71.3 -36.43 71.64 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.835 0.854 . . . . 0.0 112.692 178.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -159.01 111.15 2.18 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.307 1.443 . . . . 0.0 110.902 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.82 101.71 5.21 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.919 0.888 . . . . 0.0 111.792 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -68.32 147.91 51.48 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.436 1.094 . . . . 0.0 111.659 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.1 mt -71.85 -31.01 66.06 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.701 0.801 . . . . 0.0 113.041 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.6 mp0 -141.37 155.61 45.9 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.777 2.031 . . . . 0.0 110.739 172.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.86 107.45 4.03 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.447 0.699 . . . . 0.0 110.878 173.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.2 pp -85.03 148.61 26.08 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.193 1.397 . . . . 0.0 112.81 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.54 160.29 36.5 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.468 1.907 . . . . 0.0 111.599 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 52.8 p-10 -136.67 11.02 3.17 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.463 1.505 . . . . 0.0 113.839 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -69.73 130.03 41.23 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.013 1.325 . . . . 0.0 111.173 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -147.34 162.41 39.02 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.557 1.543 . . . . 0.0 111.81 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 92.3 p -151.45 160.32 43.78 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.188 1.395 . . . . 0.0 112.277 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 63.4 tp -70.75 -34.21 71.62 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.394 1.078 . . . . 0.0 113.087 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 84.5 p -158.64 163.23 37.1 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.479 1.512 . . . . 0.0 112.249 -175.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -68.47 152.29 45.61 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.799 1.24 . . . . 0.0 112.374 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.097 1.759 . . . . 0.0 113.222 174.339 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 ttp -150.67 141.5 14.75 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 125.316 1.446 . . . . 0.0 111.057 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.74 151.7 74.77 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.158 2.572 . . . . 0.0 113.89 176.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -69.12 161.18 46.88 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.301 2.667 . . . . 0.0 112.233 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.18 146.86 93.14 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.304 2.669 . . . . 0.0 113.544 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.29 -6.17 58.6 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -82.17 32.6 0.39 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.34 2.256 . . . . 0.0 113.801 -173.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.3 mt -119.44 136.12 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 124.903 1.281 . . . . 0.0 111.324 -169.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.0 m -133.41 132.46 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.701 1.6 . . . . 0.0 112.068 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -75.74 138.43 41.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.305 1.042 . . . . 0.0 111.306 175.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m -139.92 157.56 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.351 1.461 . . . . 0.0 111.949 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -111.8 143.58 42.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.811 1.244 . . . . 0.0 109.708 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.6 mt -130.07 125.1 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.761 0.824 . . . . 0.0 110.622 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -86.63 144.81 26.99 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.587 1.555 . . . . 0.0 112.898 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -154.72 142.8 14.27 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 125.815 1.646 . . . . 0.0 110.415 169.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.34 140.28 75.98 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.733 2.288 . . . . 0.0 113.51 -174.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.77 14.08 69.74 Favored Glycine 0 CA--C 1.539 1.534 0 N-CA-C 115.31 0.884 . . . . 0.0 115.31 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.45 156.62 48.36 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.274 1.429 . . . . 0.0 112.805 -177.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -69.08 150.96 97.37 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.918 0.887 . . . . 0.0 111.396 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.17 125.88 18.08 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.792 2.328 . . . . 0.0 111.914 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -83.65 114.83 21.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.89 0.876 . . . . 0.0 110.523 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.6 mt -81.81 134.49 35.43 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.859 0.864 . . . . 0.0 109.815 169.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ppp? -158.36 178.98 9.57 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.575 1.15 . . . . 0.0 111.607 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -124.88 119.75 29.7 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.414 1.086 . . . . 0.0 111.309 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.1 mt -86.11 114.01 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 125.115 1.366 . . . . 0.0 109.085 174.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -88.8 117.24 27.64 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.004 0.922 . . . . 0.0 109.108 168.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -66.43 -14.47 62.22 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -88.12 -17.38 31.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.944 1.297 . . . . 0.0 113.906 172.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -79.32 147.01 67.82 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-N 119.628 1.103 . . . . 0.0 111.462 172.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.35 141.48 51.62 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.823 2.349 . . . . 0.0 111.086 175.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.96 -30.71 70.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.944 -0.551 . . . . 0.0 112.212 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m -59.92 -43.56 94.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.187 0.903 . . . . 0.0 112.734 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -39.32 79.71 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.793 -0.567 . . . . 0.0 111.975 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 83.8 mt -63.63 -48.45 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.503 0.721 . . . . 0.0 110.438 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.1 mt -61.58 -38.49 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.334 1.053 . . . . 0.0 110.768 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.06 -42.6 90.71 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 119.066 0.848 . . . . 0.0 112.146 170.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -69.01 -30.07 68.38 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.364 1.066 . . . . 0.0 112.974 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.49 -53.51 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 121.46 -0.775 . . . . 0.0 110.612 169.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -60.83 -43.49 98.19 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.776 0.83 . . . . 0.0 112.072 -176.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.88 -29.93 69.85 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.074 0.949 . . . . 0.0 112.891 175.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.99 -23.93 64.29 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.365 0.984 . . . . 0.0 114.295 174.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.4 m0 -115.57 14.21 16.51 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.907 1.683 . . . . 0.0 113.234 172.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.85 28.09 11.93 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.056 1.742 . . . . 0.0 114.346 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.1 mt -74.25 122.99 23.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.029 1.331 . . . . 0.0 111.283 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.56 164.56 26.44 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.489 1.116 . . . . 0.0 112.336 172.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.2 m120 54.85 50.58 15.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.243 1.417 . . . . 0.0 113.59 173.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -57.42 -20.69 31.73 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.151 0.98 . . . . 0.0 113.385 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -54.99 -28.83 54.97 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.229 1.412 . . . . 0.0 113.072 171.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -78.9 -16.45 57.01 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.222 1.009 . . . . 0.0 112.989 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -92.78 159.26 15.48 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.76 148.87 34.63 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.089 2.156 . . . . 0.0 110.202 171.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.0 mt -81.5 153.19 26.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.462 0.648 . . . . 0.0 109.586 167.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -150.56 150.28 31.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.495 . . . . 0.0 109.331 -170.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -74.78 134.69 41.77 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.945 -1.097 . . . . 0.0 112.082 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.34 40.21 0.48 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.516 1.127 . . . . 0.0 112.392 173.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -145.15 174.45 11.05 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.295 1.838 . . . . 0.0 111.413 -172.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.7 m -58.12 146.68 32.5 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.805 1.242 . . . . 0.0 112.257 174.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.4 m 64.08 115.11 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 127.089 2.156 . . . . 0.0 113.008 -169.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 -78.78 58.28 2.28 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.1 1.36 . . . . 0.0 113.658 -170.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -65.43 97.71 0.31 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.337 1.055 . . . . 0.0 112.479 174.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -64.89 139.69 58.79 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.612 -0.68 . . . . 0.0 109.772 168.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.3 mm -80.08 131.03 35.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.652 0.739 . . . . 0.0 110.711 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 45.5 p -148.39 171.76 15.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.214 2.206 . . . . 0.0 109.321 -173.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.79 -21.54 60.96 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.905 -1.122 . . . . 0.0 113.288 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -84.02 -28.07 27.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.472 1.509 . . . . 0.0 113.564 173.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -109.53 -21.25 12.55 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -170.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.07 -25.15 65.16 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -173.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -62.66 -22.4 66.42 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.693 1.197 . . . . 0.0 113.298 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -74.48 -14.66 60.85 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.913 0.885 . . . . 0.0 113.033 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 69.7 mt -73.26 132.74 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.475 1.11 . . . . 0.0 109.876 174.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -125.8 169.78 12.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.28 1.832 . . . . 0.0 112.283 174.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -58.99 128.22 36.12 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.742 -0.599 . . . . 0.0 111.08 173.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.88 8.76 78.88 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.93 1.252 . . . . 0.0 115.417 -175.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.9 m -64.83 133.57 52.21 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 119.643 1.722 . . . . 0.0 111.179 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.3 mt -95.32 121.33 45.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.576 0.75 . . . . 0.0 109.194 170.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.5 mt -113.25 175.2 5.55 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.846 2.058 . . . . 0.0 110.555 177.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -139.07 148.7 43.68 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.295 1.838 . . . . 0.0 110.257 169.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.7 tp -89.68 139.53 30.47 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.47 1.108 . . . . 0.0 110.327 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.66 154.41 28.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.206 1.002 . . . . 0.0 110.823 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 29.1 p -73.16 136.7 44.82 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.768 -1.208 . . . . 0.0 110.76 169.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 29.3 t -66.28 141.38 97.25 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 125.057 1.343 . . . . 0.0 112.167 -174.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -62.52 -20.02 69.41 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 122.712 2.275 . . . . 0.0 112.684 172.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -84.89 -12.19 53.98 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -7.94 30.55 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 -169.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -133.01 9.33 4.13 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.376 1.471 . . . . 0.0 112.69 174.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.15 165.56 13.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.2 1.4 . . . . 0.0 113.141 -177.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -67.04 156.02 37.15 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.245 1.018 . . . . 0.0 110.776 168.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -57.25 121.33 9.87 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.215 1.006 . . . . 0.0 111.285 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -76.46 -39.78 52.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.813 0.845 . . . . 0.0 113.27 -170.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -164.07 166.44 21.36 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.061 1.744 . . . . 0.0 111.367 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -152.61 141.01 20.64 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.825 1.25 . . . . 0.0 111.014 170.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.83 92.16 3.94 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.929 1.692 . . . . 0.0 109.6 177.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 81.7 mt -67.91 139.21 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.726 0.81 . . . . 0.0 109.703 176.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -81.25 41.35 0.6 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.911 1.284 . . . . 0.0 112.87 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 75.6 p -78.17 -21.61 49.92 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.208 1.403 . . . . 0.0 113.953 -176.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 39.3 p -68.98 121.06 15.86 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.922 1.289 . . . . 0.0 111.924 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 28.4 t -160.35 158.8 30.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.656 1.582 . . . . 0.0 111.396 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.3 tpt -150.77 131.46 14.01 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.316 1.446 . . . . 0.0 111.177 177.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 57.2 p-10 -141.34 -3.17 1.2 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.218 1.407 . . . . 0.0 114.163 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.96 4.7 32.41 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.098 1.359 . . . . 0.0 114.162 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -64.42 139.7 58.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.189 1.396 . . . . 0.0 112.35 -174.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -73.99 46.23 0.23 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.191 2.196 . . . . 0.0 114.386 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -59.7 140.39 56.49 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.744 1.218 . . . . 0.0 113.182 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -154.86 163.32 40.45 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.996 1.719 . . . . 0.0 111.572 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.8 mt -133.29 151.35 51.89 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.716 1.606 . . . . 0.0 111.589 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.5 mtpp -72.42 152.03 42.24 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.81 1.244 . . . . 0.0 111.845 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -70.53 139.25 51.52 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.571 0.748 . . . . 0.0 111.812 172.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 69.4 tp -76.1 120.65 21.68 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.009 0.924 . . . . 0.0 111.266 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -73.11 133.39 44.12 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.508 0.723 . . . . 0.0 111.425 171.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.7 t -160.33 151.0 18.61 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.857 1.263 . . . . 0.0 111.643 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -145.22 -0.65 0.87 Allowed 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.5 p -69.74 119.58 14.2 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 121.157 -0.965 . . . . 0.0 111.418 -178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.9 mmp_? 55.34 27.91 10.63 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 126.073 1.749 . . . . 0.0 114.124 -176.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.5 t0 . . . . . 0 C--O 1.254 1.312 0 C-N-CA 125.923 1.689 . . . . 0.0 113.128 177.765 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.536 0 N-CA-C 111.837 -0.505 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptp -67.13 150.58 97.84 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 124.015 0.926 . . . . 0.0 112.618 178.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.65 154.12 74.24 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 123.027 2.485 . . . . 0.0 112.064 173.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.64 152.69 74.41 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 123.313 2.676 . . . . 0.0 112.452 177.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.18 141.48 52.48 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.213 2.609 . . . . 0.0 111.633 175.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.94 143.07 37.95 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.033 0.933 . . . . 0.0 112.7 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -121.99 16.3 10.84 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.967 1.707 . . . . 0.0 112.859 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mt -66.65 139.75 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 125.889 1.675 . . . . 0.0 111.452 -171.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.61 131.59 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.622 1.569 . . . . 0.0 112.272 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -79.08 137.81 37.68 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.734 1.214 . . . . 0.0 110.886 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.43 160.17 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.89 1.676 . . . . 0.0 112.341 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.41 116.95 26.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.261 . . . . 0.0 110.356 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.2 mt -105.1 126.49 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.911 0.885 . . . . 0.0 111.007 -171.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -84.02 142.31 30.56 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.848 1.659 . . . . 0.0 112.849 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -155.27 142.58 13.81 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 125.918 1.687 . . . . 0.0 110.424 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.21 145.53 93.41 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.708 2.272 . . . . 0.0 114.008 -175.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.14 12.25 71.73 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.508 0.963 . . . . 0.0 115.508 177.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.5 158.08 43.93 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.279 1.431 . . . . 0.0 112.536 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -70.06 155.21 93.83 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 123.84 0.856 . . . . 0.0 111.52 169.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -59.48 130.0 33.66 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.814 2.342 . . . . 0.0 112.698 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -80.19 106.71 12.4 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.024 0.93 . . . . 0.0 109.982 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 60.4 mt -76.05 125.16 28.61 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.625 0.77 . . . . 0.0 109.401 169.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -153.95 178.26 10.12 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -114.91 125.75 54.0 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.154 0.982 . . . . 0.0 111.152 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.3 mt -88.43 108.58 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 170.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -80.87 114.21 19.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.095 0.558 . . . . 0.0 109.774 169.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -68.29 -11.24 59.11 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -76.81 -34.65 57.91 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.373 0.988 . . . . 0.0 112.802 169.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -76.97 145.13 73.36 Favored Pre-proline 0 N--CA 1.481 1.075 0 C-N-CA 125.283 1.433 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.86 142.87 64.54 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.046 2.497 . . . . 0.0 111.17 175.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -59.1 -32.94 70.27 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-O 118.545 -0.74 . . . . 0.0 112.29 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.41 -41.52 85.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.64 1.109 . . . . 0.0 112.563 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.97 72.69 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.072 0.549 . . . . 0.0 112.254 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.67 -46.73 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.195 0.598 . . . . 0.0 110.332 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.4 mt -60.42 -38.57 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 125.043 1.337 . . . . 0.0 110.935 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -57.05 -46.92 82.07 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.246 0.93 . . . . 0.0 111.565 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -67.22 -28.57 68.18 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.509 1.124 . . . . 0.0 113.324 177.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.79 -52.33 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.523 1.056 . . . . 0.0 110.023 169.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.5 m -61.8 -44.27 97.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.901 0.881 . . . . 0.0 111.793 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -59.11 -29.21 67.21 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.12 1.368 . . . . 0.0 112.905 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.07 -23.47 66.02 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.401 1.0 . . . . 0.0 114.469 173.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -117.33 13.7 14.59 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.032 1.733 . . . . 0.0 113.23 172.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t 55.52 28.53 11.89 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.115 1.766 . . . . 0.0 114.351 -176.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.5 mt -74.21 125.29 28.07 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.314 1.446 . . . . 0.0 111.458 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.68 163.61 27.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.53 1.132 . . . . 0.0 112.516 174.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 54.25 53.29 11.17 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.637 1.575 . . . . 0.0 113.89 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 -58.26 -18.11 24.22 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.171 0.988 . . . . 0.0 113.562 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -55.84 -28.84 58.34 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.986 1.315 . . . . 0.0 113.008 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -79.68 -15.84 56.83 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.03 0.932 . . . . 0.0 112.771 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -94.43 159.27 15.18 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.625 1.202 . . . . 0.0 114.11 -169.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.32 151.24 36.26 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.396 2.278 . . . . 0.0 110.105 173.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.0 mt -82.33 156.64 24.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 166.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -148.87 150.08 32.37 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.649 1.18 . . . . 0.0 110.496 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -67.2 147.24 53.32 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.608 -0.682 . . . . 0.0 112.795 173.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.34 -22.49 0.91 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.678 1.191 . . . . 0.0 113.857 173.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -64.07 -41.18 97.43 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.397 0.999 . . . . 0.0 112.792 175.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.2 t -155.84 128.57 7.9 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.588 1.555 . . . . 0.0 109.881 173.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.5 t 57.9 179.91 0.06 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.283 1.433 . . . . 0.0 113.681 -169.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -130.54 38.13 3.77 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.824 2.05 . . . . 0.0 112.027 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -61.19 133.28 55.78 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.309 -0.87 . . . . 0.0 111.076 171.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -69.8 142.18 53.2 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.971 -0.456 . . . . 0.0 110.623 170.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 41.6 mm -81.51 134.21 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.228 1.011 . . . . 0.0 110.307 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -143.95 168.9 18.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.271 1.828 . . . . 0.0 109.661 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.21 -13.5 28.38 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.685 -1.259 . . . . 0.0 113.213 174.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -99.07 -6.75 27.86 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.633 1.973 . . . . 0.0 114.282 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.58 -15.97 4.39 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.094 1.358 . . . . 0.0 113.969 -173.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.95 -19.53 62.84 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -62.31 -22.51 66.11 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.843 1.257 . . . . 0.0 112.838 173.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -75.56 -13.45 60.35 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.108 0.963 . . . . 0.0 113.253 176.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.92 131.26 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.184 0.994 . . . . 0.0 109.603 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -124.61 169.85 11.52 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.912 1.685 . . . . 0.0 111.791 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -57.13 126.1 25.68 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 111.278 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.22 11.06 76.63 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.075 1.322 . . . . 0.0 115.445 -176.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.3 m -67.26 128.8 37.75 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.626 1.713 . . . . 0.0 111.405 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -83.36 126.23 40.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 169.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.7 mt -121.47 175.56 6.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.678 1.991 . . . . 0.0 110.867 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 73.8 ttt-85 -137.53 133.53 34.63 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 127.364 2.266 . . . . 0.0 110.033 176.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.5 tp -81.86 137.48 35.23 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 167.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.0 t -157.08 152.76 26.84 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.134 0.574 . . . . 0.0 111.239 -175.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.1 p -70.62 138.94 51.22 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.131 -0.981 . . . . 0.0 109.304 167.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.5 t -64.17 152.4 88.16 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 126.022 1.729 . . . . 0.0 112.003 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -72.39 -17.67 26.95 Favored 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 123.043 2.495 . . . . 0.0 112.775 168.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -110.4 -39.58 4.9 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.386 1.474 . . . . 0.0 113.656 -177.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 56.08 32.17 19.53 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.958 1.703 . . . . 0.0 113.82 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -147.51 158.59 44.06 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.907 1.683 . . . . 0.0 111.285 -174.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.24 156.19 36.94 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.638 1.175 . . . . 0.0 113.383 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -147.92 141.86 25.86 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.071 1.748 . . . . 0.0 109.866 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -125.97 -8.69 6.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.045 1.338 . . . . 0.0 114.526 -175.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.2 mp -78.77 94.07 5.07 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.003 0.921 . . . . 0.0 110.534 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -139.0 164.65 29.19 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.924 1.689 . . . . 0.0 112.023 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -112.44 151.85 29.38 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.273 1.429 . . . . 0.0 111.276 174.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -61.93 128.86 38.21 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.933 1.293 . . . . 0.0 111.53 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 89.0 mt -74.9 120.07 23.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.662 0.785 . . . . 0.0 109.037 173.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -146.84 31.19 0.95 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.003 1.321 . . . . 0.0 111.559 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 16.5 m -66.25 154.25 40.39 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.477 1.511 . . . . 0.0 113.232 -176.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 75.7 p -72.87 -8.02 53.61 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.159 1.383 . . . . 0.0 114.668 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.0 t 65.88 160.84 0.14 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.314 2.246 . . . . 0.0 114.745 -175.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -79.86 160.31 26.11 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.685 1.194 . . . . 0.0 113.307 -174.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -128.44 32.71 4.8 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.695 1.598 . . . . 0.0 111.675 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.64 -3.67 45.15 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.371 1.468 . . . . 0.0 114.707 -174.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -65.39 145.74 55.78 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.699 1.2 . . . . 0.0 111.664 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 95.1 mt -129.15 174.41 9.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.384 1.874 . . . . 0.0 110.785 174.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -146.49 32.72 0.96 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.985 1.314 . . . . 0.0 112.441 172.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.51 147.15 53.89 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.733 1.213 . . . . 0.0 112.334 174.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.9 mt -140.41 160.37 40.15 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.845 1.658 . . . . 0.0 111.879 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -143.15 -36.1 0.38 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.444 1.498 . . . . 0.0 113.093 176.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -150.48 154.09 37.05 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.773 1.629 . . . . 0.0 110.776 175.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 97.8 mt -130.31 -2.75 4.41 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.809 2.044 . . . . 0.0 113.143 179.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -72.03 -15.87 62.04 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.8 m -63.67 146.04 54.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.11 1.364 . . . . 0.0 113.081 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 96.5 mt -135.84 152.61 51.23 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.98 1.712 . . . . 0.0 111.471 178.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.8 m -143.35 155.83 44.53 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.625 1.57 . . . . 0.0 111.954 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.11 154.21 42.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.468 1.107 . . . . 0.0 112.015 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.0 t0 . . . . . 0 C--O 1.254 1.307 0 C-N-CA 126.119 1.768 . . . . 0.0 111.945 179.792 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.9 mtp -69.24 149.72 97.41 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.159 0.983 . . . . 0.0 112.458 177.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -67.24 157.34 62.22 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 123.443 2.762 . . . . 0.0 112.557 175.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -67.18 154.15 75.2 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.262 2.641 . . . . 0.0 112.374 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.44 64.18 7.25 Favored 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 124.779 3.653 . . . . 0.0 112.507 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 58.2 34.04 23.74 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 126.434 1.894 . . . . 0.0 115.019 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -75.68 9.69 2.15 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.9 mt -132.77 134.97 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.634 1.574 . . . . 0.0 109.589 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 m -134.36 132.45 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.349 1.46 . . . . 0.0 111.489 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -77.16 144.09 38.62 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.53 155.19 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 125.922 1.689 . . . . 0.0 111.391 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.9 112.95 21.02 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.563 1.145 . . . . 0.0 110.331 175.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.2 mt -102.52 126.4 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.909 0.884 . . . . 0.0 111.075 -169.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -82.24 146.87 29.26 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.14 1.776 . . . . 0.0 113.215 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -154.25 141.39 13.45 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 125.854 1.662 . . . . 0.0 110.232 168.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.54 138.1 73.58 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.664 2.243 . . . . 0.0 113.463 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.07 12.77 72.15 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.309 0.883 . . . . 0.0 115.309 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.85 152.96 50.85 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.222 1.409 . . . . 0.0 112.641 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -68.99 150.67 97.54 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 123.898 0.879 . . . . 0.0 111.072 170.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.37 129.68 30.78 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.471 2.114 . . . . 0.0 113.179 -179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -80.57 110.75 16.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.608 1.163 . . . . 0.0 110.36 176.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.3 mt -77.33 126.54 31.09 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.487 0.715 . . . . 0.0 109.818 169.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.0 ptm -155.02 177.46 11.3 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.291 1.036 . . . . 0.0 111.555 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -112.74 136.07 52.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.962 0.905 . . . . 0.0 112.6 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.8 mt -96.78 109.49 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 125.563 1.545 . . . . 0.0 107.914 169.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -84.56 116.84 23.36 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -66.98 -11.78 57.86 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -86.62 -22.54 26.13 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.747 1.219 . . . . 0.0 113.63 170.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -82.12 142.82 48.14 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.324 1.05 . . . . 0.0 111.57 175.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.57 144.9 68.39 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.403 2.736 . . . . 0.0 111.621 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.5 mt -60.33 -32.67 71.46 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.084 176.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 m -58.85 -42.9 90.43 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.418 1.008 . . . . 0.0 112.583 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.56 -39.4 77.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.067 0.547 . . . . 0.0 111.981 174.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.46 -46.35 95.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.523 0.729 . . . . 0.0 110.687 176.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.8 mt -60.84 -38.24 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.93 1.292 . . . . 0.0 111.281 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.04 -38.7 89.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.4 0.68 . . . . 0.0 112.251 171.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.34 -24.74 62.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.235 1.014 . . . . 0.0 113.195 173.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.6 t -69.87 -58.04 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 119.604 1.093 . . . . 0.0 110.704 169.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 15.3 p -63.74 -33.52 75.83 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.502 0.721 . . . . 0.0 112.654 -169.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -61.43 -26.98 68.23 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.58 1.152 . . . . 0.0 113.045 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.36 -22.86 71.48 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.279 0.942 . . . . 0.0 114.225 174.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -119.03 11.81 12.56 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.985 1.714 . . . . 0.0 113.27 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 m 54.5 29.92 12.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.025 1.73 . . . . 0.0 114.376 -175.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.9 mt -77.6 127.03 31.8 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.542 1.137 . . . . 0.0 110.445 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.18 160.6 27.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.522 1.129 . . . . 0.0 113.445 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 51.55 69.11 0.7 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.774 2.03 . . . . 0.0 113.261 170.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -60.56 -18.83 55.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.546 1.138 . . . . 0.0 113.72 -176.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -54.75 -28.28 47.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.227 1.411 . . . . 0.0 112.933 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -78.29 -17.93 55.95 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.859 0.863 . . . . 0.0 113.204 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -99.21 158.58 15.59 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -168.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.79 149.83 33.09 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.597 1.959 . . . . 0.0 110.256 171.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.4 mt -76.56 154.67 34.28 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.445 0.64 . . . . 0.0 109.43 167.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -148.58 156.58 42.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.279 1.831 . . . . 0.0 108.808 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 -66.34 150.66 48.53 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.74 -1.225 . . . . 0.0 111.984 170.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.14 -11.35 60.9 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 178.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -61.19 168.36 2.61 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.549 1.539 . . . . 0.0 112.797 172.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.9 m -66.4 -36.07 81.91 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.524 1.129 . . . . 0.0 113.509 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.1 t -74.16 147.29 42.76 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.869 0.868 . . . . 0.0 112.867 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -80.8 50.58 1.37 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.976 1.311 . . . . 0.0 114.343 -170.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -71.28 74.17 0.7 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.55 1.14 . . . . 0.0 112.279 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -59.3 135.48 57.66 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.805 0.842 . . . . 0.0 110.713 171.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.4 mm -80.71 134.35 27.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 123.942 0.897 . . . . 0.0 110.586 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -131.78 163.1 28.95 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.38 1.872 . . . . 0.0 111.029 -176.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -61.7 -16.24 47.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -86.04 -52.68 5.54 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.938 1.295 . . . . 0.0 112.693 169.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -86.67 -12.24 48.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -169.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.8 ptm180 -54.64 -23.42 17.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.972 1.309 . . . . 0.0 114.269 173.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -65.35 -18.61 65.45 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.11 1.364 . . . . 0.0 113.363 175.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -80.59 -12.68 59.48 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 113.533 173.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -71.0 134.26 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.902 0.881 . . . . 0.0 109.776 175.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -121.38 165.26 15.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.501 1.52 . . . . 0.0 112.219 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -60.53 123.16 16.55 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.001 0.52 . . . . 0.0 110.985 177.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.43 11.0 63.08 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.259 1.409 . . . . 0.0 115.476 -174.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.3 m -66.15 129.71 40.73 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.729 1.765 . . . . 0.0 110.973 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.2 mt -85.11 125.18 40.39 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.7 mt -119.06 -179.42 3.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.682 1.993 . . . . 0.0 110.714 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.5 ttp-105 -145.89 135.47 23.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 127.637 2.375 . . . . 0.0 110.09 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.5 tp -84.45 138.25 32.92 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.592 0.757 . . . . 0.0 109.827 169.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.2 t -160.15 155.55 25.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.996 0.918 . . . . 0.0 110.369 -177.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.0 p -70.33 148.82 48.02 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.743 -1.223 . . . . 0.0 111.183 170.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.5 p -62.14 159.38 38.93 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 124.77 1.228 . . . . 0.0 113.916 -171.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.54 -23.43 57.37 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 122.291 1.994 . . . . 0.0 112.829 176.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.53 -39.81 57.83 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.419 1.088 . . . . 0.0 112.374 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -66.7 -34.13 77.17 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.567 -0.708 . . . . 0.0 112.358 174.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -77.93 -5.7 51.99 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.311 1.044 . . . . 0.0 113.795 171.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . 60.05 -26.59 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 130.043 3.337 . . . . 0.0 117.856 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -76.67 -16.91 59.41 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.693 1.597 . . . . 0.0 113.652 -174.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 47.68 46.26 18.09 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.52 1.928 . . . . 0.0 115.213 170.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -61.68 143.69 55.75 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.423 1.089 . . . . 0.0 111.944 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -138.16 -11.83 1.45 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.096 1.358 . . . . 0.0 113.313 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -70.73 115.03 9.41 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.75 2.02 . . . . 0.0 111.159 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -64.74 129.55 40.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.978 0.911 . . . . 0.0 111.327 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 71.6 mt -82.87 113.65 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 123.53 0.732 . . . . 0.0 109.41 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -78.54 -23.56 46.13 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.382 1.073 . . . . 0.0 113.363 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 29.2 t -69.49 143.16 53.58 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.393 1.077 . . . . 0.0 112.858 -178.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.7 t -154.62 141.2 18.88 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.485 1.514 . . . . 0.0 111.204 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.6 t -77.62 -40.72 41.03 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.013 0.925 . . . . 0.0 113.451 -176.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 46.3 ttp -157.64 154.95 29.23 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.188 1.395 . . . . 0.0 111.621 -174.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -64.32 -14.83 58.44 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -175.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -143.71 150.23 38.36 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.84 1.656 . . . . 0.0 110.957 173.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -99.13 138.71 35.84 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.738 1.215 . . . . 0.0 111.697 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.8 mp -137.93 148.63 45.45 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.827 1.651 . . . . 0.0 110.825 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -142.81 149.87 39.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.781 1.632 . . . . 0.0 111.3 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.14 143.89 47.13 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.724 0.809 . . . . 0.0 112.526 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.0 mt -125.1 19.55 8.31 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.738 1.615 . . . . 0.0 112.834 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -66.81 148.67 51.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.164 1.386 . . . . 0.0 112.213 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.9 133.06 48.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.841 0.856 . . . . 0.0 112.11 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.89 145.64 36.09 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.129 0.972 . . . . 0.0 111.716 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -70.87 141.96 51.21 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.796 0.838 . . . . 0.0 112.241 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.6 t -159.96 157.98 29.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.28 1.432 . . . . 0.0 111.617 178.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 98.3 mt -132.27 106.96 8.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.838 1.655 . . . . 0.0 110.046 175.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 18.5 m -79.99 -15.06 58.02 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -176.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 95.8 mtm-85 -73.33 152.04 41.05 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.146 1.378 . . . . 0.0 112.819 -177.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 . . . . . 0 C--O 1.255 1.343 0 C-N-CA 127.426 2.29 . . . . 0.0 114.319 177.755 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 112.143 -0.383 . . . . 0.0 112.143 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -66.48 150.31 97.36 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.095 0.958 . . . . 0.0 112.658 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.05 157.13 63.16 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.202 2.601 . . . . 0.0 112.512 175.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.73 155.86 68.56 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 123.475 2.783 . . . . 0.0 112.424 175.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -66.87 148.79 82.87 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.428 2.752 . . . . 0.0 112.716 178.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.06 164.65 26.3 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.626 1.17 . . . . 0.0 112.944 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -77.29 63.87 2.58 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.759 1.624 . . . . 0.0 112.371 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.9 mt -108.05 137.39 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.347 1.459 . . . . 0.0 111.114 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.3 m -133.11 135.05 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.636 1.574 . . . . 0.0 111.928 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -76.11 142.52 41.66 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.078 0.951 . . . . 0.0 111.676 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.7 m -142.34 157.31 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.563 1.545 . . . . 0.0 111.889 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.06 123.09 43.62 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.869 1.268 . . . . 0.0 110.029 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -111.09 126.09 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.02 0.928 . . . . 0.0 110.836 -170.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -83.54 142.23 31.03 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.033 1.733 . . . . 0.0 112.733 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -155.06 142.72 14.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.89 1.676 . . . . 0.0 110.535 170.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.32 142.98 88.03 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.681 2.254 . . . . 0.0 113.78 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.05 13.83 70.23 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 177.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.0 157.45 45.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.198 1.399 . . . . 0.0 112.645 -176.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -69.05 152.46 96.77 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.826 0.85 . . . . 0.0 111.411 170.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -60.33 128.4 26.07 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.737 2.291 . . . . 0.0 112.36 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -81.25 111.22 17.46 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.939 0.895 . . . . 0.0 110.283 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -78.32 128.69 34.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.579 0.752 . . . . 0.0 109.592 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.1 ptm -154.99 178.59 10.02 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.706 0.802 . . . . 0.0 112.418 174.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 -112.08 129.74 56.12 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.791 1.237 . . . . 0.0 111.481 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.9 mt -97.76 111.76 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 125.259 1.424 . . . . 0.0 108.362 170.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -85.95 117.36 24.75 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.966 -0.754 . . . . 0.0 108.966 169.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -66.24 -14.76 62.45 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -80.78 -30.81 35.96 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.139 1.375 . . . . 0.0 113.664 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -73.55 143.22 82.0 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 124.188 0.995 . . . . 0.0 111.377 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.85 142.39 62.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.015 2.477 . . . . 0.0 111.108 177.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -59.36 -32.43 70.11 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.539 -0.744 . . . . 0.0 112.173 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m -58.51 -41.86 86.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.624 1.102 . . . . 0.0 112.76 176.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.78 -40.9 72.31 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.064 0.546 . . . . 0.0 112.127 175.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.61 -46.09 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.399 0.68 . . . . 0.0 110.533 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.36 -37.34 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.826 1.251 . . . . 0.0 110.969 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -61.26 -41.94 97.78 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.477 1.035 . . . . 0.0 112.243 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -66.84 -28.51 68.41 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.392 1.077 . . . . 0.0 112.959 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.0 -54.29 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.374 0.988 . . . . 0.0 110.177 168.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -61.22 -41.77 97.44 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.222 1.009 . . . . 0.0 112.137 -174.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.05 -29.85 68.8 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.142 0.977 . . . . 0.0 112.925 175.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.91 -23.35 65.59 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.348 0.975 . . . . 0.0 114.403 174.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -117.54 14.41 14.53 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.982 1.713 . . . . 0.0 113.177 172.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.67 28.58 12.28 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.099 1.76 . . . . 0.0 114.337 -177.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.6 mt -74.79 127.36 32.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.17 1.388 . . . . 0.0 111.622 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.63 165.51 24.18 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.689 1.196 . . . . 0.0 112.461 173.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 53.96 54.77 9.24 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.558 1.543 . . . . 0.0 113.629 173.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -58.31 -21.2 48.31 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.928 0.891 . . . . 0.0 112.987 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -56.61 -28.14 59.75 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.548 1.539 . . . . 0.0 112.827 175.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -80.63 -17.5 51.08 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.967 0.907 . . . . 0.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -90.77 159.9 16.07 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.539 1.162 . . . . 0.0 113.869 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.24 151.27 37.31 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.789 2.436 . . . . 0.0 109.828 172.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.7 mt -82.92 158.61 22.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 166.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -149.4 145.64 27.06 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 124.648 1.179 . . . . 0.0 110.494 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.0 m-70 -68.26 129.08 38.84 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.67 -0.644 . . . . 0.0 110.996 171.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -89.43 -6.02 56.89 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -146.43 161.19 40.95 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.301 1.44 . . . . 0.0 111.812 -175.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.8 m 63.15 -47.39 0.22 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 128.699 2.799 . . . . 0.0 115.453 -172.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.5 t -160.4 149.16 16.93 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.639 1.576 . . . . 0.0 111.205 170.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -78.99 36.45 0.28 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.502 1.521 . . . . 0.0 114.028 -175.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -63.19 127.41 31.14 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.873 -1.142 . . . . 0.0 112.305 -178.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -70.28 143.12 52.18 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.133 0.573 . . . . 0.0 110.377 169.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mm -83.82 133.86 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.77 1.228 . . . . 0.0 110.549 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.3 p -144.55 165.73 27.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 127.005 2.122 . . . . 0.0 110.178 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.19 -11.91 17.13 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 121.041 -1.037 . . . . 0.0 113.344 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -90.46 -20.96 22.13 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.765 1.626 . . . . 0.0 114.585 176.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -135.51 -2.41 2.45 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -173.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.49 -22.16 12.08 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 175.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -62.59 -18.49 62.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.172 1.389 . . . . 0.0 113.415 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -73.38 -14.72 61.33 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.5 mt -72.87 128.82 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.92 0.888 . . . . 0.0 109.601 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -120.13 174.56 6.41 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.112 1.765 . . . . 0.0 112.246 172.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -57.52 130.46 46.42 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.907 -0.495 . . . . 0.0 111.24 170.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.56 10.93 83.77 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 124.71 1.148 . . . . 0.0 115.367 -177.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 90.3 m -65.67 129.65 40.5 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.618 1.709 . . . . 0.0 110.967 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 35.1 mt -86.28 122.07 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 170.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.3 mt -118.57 174.66 6.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.155 1.782 . . . . 0.0 111.082 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.2 ttt-85 -138.57 135.07 34.63 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 127.338 2.255 . . . . 0.0 109.851 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -83.24 136.66 34.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.048 0.539 . . . . 0.0 109.651 168.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.1 t -158.26 149.26 20.78 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.776 0.83 . . . . 0.0 110.82 -174.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.6 p -71.54 132.97 45.45 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.655 -1.278 . . . . 0.0 110.627 170.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.8 t -61.56 142.21 94.34 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 125.125 1.37 . . . . 0.0 112.196 -176.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -65.14 -14.05 43.07 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.965 2.443 . . . . 0.0 112.906 172.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 10.81 28.91 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.292 1.837 . . . . 0.0 114.035 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.38 151.4 28.05 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.241 -0.912 . . . . 0.0 113.448 -177.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.69 161.5 37.1 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.425 1.49 . . . . 0.0 110.802 177.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.13 145.85 55.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.295 0.638 . . . . 0.0 111.513 170.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -69.04 122.61 19.06 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.734 0.814 . . . . 0.0 111.446 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -91.26 -16.04 28.22 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -169.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.0 tp -144.82 -48.75 0.25 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -174.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 45.3 m170 -86.61 40.71 0.91 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.26 1.424 . . . . 0.0 112.661 -176.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -74.59 74.23 1.99 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.669 1.588 . . . . 0.0 113.381 -170.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 36.6 ttp85 56.43 28.24 13.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 127.143 2.177 . . . . 0.0 115.617 169.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -64.13 128.95 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.018 0.927 . . . . 0.0 110.535 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -83.71 45.37 1.06 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.44 1.496 . . . . 0.0 112.726 -177.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 78.9 p -74.93 -20.91 59.49 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.134 1.374 . . . . 0.0 114.172 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 31.0 t -69.66 129.54 39.91 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.291 1.036 . . . . 0.0 112.02 179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 38.9 m -72.24 146.5 47.23 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.628 1.171 . . . . 0.0 113.267 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.9 ptm -70.79 162.07 29.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.986 0.915 . . . . 0.0 112.085 169.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -68.17 131.14 44.87 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.666 -0.646 . . . . 0.0 111.658 172.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -76.9 148.16 36.6 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.987 0.915 . . . . 0.0 112.609 177.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -73.74 149.98 41.45 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.474 1.11 . . . . 0.0 111.626 172.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.1 mt -72.99 149.6 43.16 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.012 0.925 . . . . 0.0 111.735 174.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -143.38 157.13 44.71 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.586 1.554 . . . . 0.0 111.933 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.15 157.55 35.11 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.091 0.956 . . . . 0.0 112.622 173.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.94 136.95 56.14 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.889 0.875 . . . . 0.0 111.904 178.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.2 mmtm -141.09 26.29 2.03 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.558 1.943 . . . . 0.0 112.354 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -75.29 -21.67 58.3 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.988 1.315 . . . . 0.0 113.484 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 60.4 tp -67.98 134.8 51.34 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.798 1.239 . . . . 0.0 111.533 174.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -150.25 166.13 30.87 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.309 1.444 . . . . 0.0 112.045 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.2 t -150.37 137.2 19.17 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.287 1.435 . . . . 0.0 110.89 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 94.8 mt -136.31 156.87 48.03 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.937 1.695 . . . . 0.0 111.824 -176.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.6 t -62.96 -18.32 63.04 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -69.85 -25.09 63.57 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.972 1.709 . . . . 0.0 113.543 173.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.402 1.481 . . . . 0.0 114.042 -174.397 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.645 0 N-CA-C 111.806 -0.517 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.9 mtm -69.13 147.83 97.58 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 123.856 0.863 . . . . 0.0 112.295 177.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -61.22 147.97 94.17 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 123.097 2.531 . . . . 0.0 113.61 176.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.37 156.44 61.75 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 123.338 2.692 . . . . 0.0 112.131 173.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -67.0 144.45 70.04 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.139 2.559 . . . . 0.0 111.937 174.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.86 152.42 33.38 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.957 0.903 . . . . 0.0 112.615 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -79.91 51.25 1.3 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.025 1.33 . . . . 0.0 112.204 175.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.1 mt -127.66 136.33 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.329 1.452 . . . . 0.0 109.973 -172.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.7 m -133.2 131.71 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.23 1.412 . . . . 0.0 111.945 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -77.46 138.58 39.33 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.957 0.903 . . . . 0.0 111.168 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -137.47 157.07 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.7 1.6 . . . . 0.0 111.62 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.91 132.4 55.33 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.266 1.026 . . . . 0.0 109.886 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.0 mt -121.28 123.55 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.042 0.937 . . . . 0.0 110.628 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -82.46 143.85 30.86 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.151 1.381 . . . . 0.0 112.899 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -156.09 143.8 14.07 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.915 1.686 . . . . 0.0 110.161 169.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -62.77 144.98 94.71 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.665 2.243 . . . . 0.0 113.918 -175.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.0 11.48 74.46 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.82 155.66 44.21 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.192 1.397 . . . . 0.0 112.585 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -70.09 152.53 95.77 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 123.507 0.723 . . . . 0.0 110.955 169.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -59.21 130.76 37.59 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.45 2.1 . . . . 0.0 113.408 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -78.47 118.09 20.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.726 1.21 . . . . 0.0 110.488 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.1 131.48 35.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.292 0.637 . . . . 0.0 109.404 168.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.8 ptm -155.73 176.71 12.26 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.145 0.978 . . . . 0.0 111.644 172.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -115.31 129.82 56.72 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.149 0.98 . . . . 0.0 111.745 176.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.8 mt -95.44 112.36 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 125.8 1.64 . . . . 0.0 108.504 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -86.32 116.99 24.84 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.353 1.061 . . . . 0.0 109.966 171.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -68.2 -13.36 62.18 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -78.76 -31.03 46.02 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.338 0.972 . . . . 0.0 113.184 169.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -77.03 144.88 72.73 Favored Pre-proline 0 N--CA 1.48 1.034 0 C-N-CA 123.984 0.914 . . . . 0.0 112.042 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.2 143.26 70.43 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.124 2.55 . . . . 0.0 111.214 175.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.34 -30.28 69.43 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.117 -0.944 . . . . 0.0 112.672 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.1 t -57.97 -47.14 83.84 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.246 1.385 . . . . 0.0 112.097 173.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.62 -40.34 95.32 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.63 -0.669 . . . . 0.0 112.13 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 94.3 mt -67.1 -45.93 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.672 0.789 . . . . 0.0 110.815 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.8 mt -61.36 -35.82 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.646 1.179 . . . . 0.0 110.645 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 tttp -62.55 -41.16 98.72 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.12 0.873 . . . . 0.0 112.394 171.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -65.37 -30.44 71.27 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.234 1.014 . . . . 0.0 113.101 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.59 -54.52 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 119.375 0.989 . . . . 0.0 110.247 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.3 m -61.36 -42.47 98.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.444 1.098 . . . . 0.0 112.089 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -60.2 -29.53 68.78 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.11 0.964 . . . . 0.0 112.859 175.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.61 -23.37 64.97 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.49 1.043 . . . . 0.0 114.364 174.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.57 16.09 14.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.939 1.696 . . . . 0.0 113.14 172.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.9 p 56.19 21.21 5.06 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.241 2.217 . . . . 0.0 115.505 -176.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.35 126.86 30.94 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.428 1.491 . . . . 0.0 111.649 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.87 164.33 24.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.697 1.199 . . . . 0.0 112.388 173.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 52.98 62.01 2.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.74 1.616 . . . . 0.0 113.464 173.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -61.17 -19.19 61.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.807 0.843 . . . . 0.0 112.808 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -53.25 -30.14 36.57 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.005 1.722 . . . . 0.0 113.198 170.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -76.69 -14.84 59.92 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.142 0.977 . . . . 0.0 113.046 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -102.38 158.55 16.12 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.886 1.275 . . . . 0.0 114.247 -168.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.77 150.97 39.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.258 2.223 . . . . 0.0 109.852 169.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.93 154.58 26.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 166.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -145.11 143.71 30.53 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.516 1.126 . . . . 0.0 109.896 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.7 m-70 -66.15 145.03 56.28 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.659 -0.651 . . . . 0.0 111.699 174.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.63 -18.93 2.13 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -178.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.8 p30 -85.54 2.96 42.68 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.957 1.466 . . . . 0.0 114.957 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.1 t -146.31 -63.24 0.31 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.091 0.957 . . . . 0.0 112.726 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -158.65 161.46 37.16 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.19 1.396 . . . . 0.0 110.984 175.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -74.54 43.53 0.19 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.767 2.027 . . . . 0.0 115.02 -169.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -67.97 125.83 27.54 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 120.716 -1.24 . . . . 0.0 111.08 174.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -68.08 142.31 55.86 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.492 -0.755 . . . . 0.0 111.388 172.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -80.99 137.53 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.1 0.96 . . . . 0.0 110.109 174.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 15.5 p -144.28 168.43 20.07 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.507 1.923 . . . . 0.0 109.447 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -63.78 -4.19 2.97 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 177.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -118.89 -15.61 9.34 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.389 1.476 . . . . 0.0 114.662 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -90.12 -22.71 21.64 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.86 1.209 . . . . 0.0 113.633 173.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -59.4 -19.82 50.16 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -173.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -63.64 -24.61 67.86 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.332 1.053 . . . . 0.0 113.056 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -74.83 -16.08 60.71 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.834 0.854 . . . . 0.0 113.097 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.6 mt -71.06 133.33 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.102 0.961 . . . . 0.0 109.841 173.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -129.7 171.37 12.72 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.364 1.865 . . . . 0.0 111.328 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -60.24 121.32 11.66 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.911 -0.493 . . . . 0.0 110.312 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.16 8.56 81.61 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.849 1.214 . . . . 0.0 115.459 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.3 m -63.38 130.72 45.64 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.893 1.847 . . . . 0.0 110.564 173.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mt -91.65 123.61 43.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 123.351 0.66 . . . . 0.0 109.425 173.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -114.96 174.27 6.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.556 1.942 . . . . 0.0 110.943 177.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -137.49 136.05 37.36 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 127.082 2.153 . . . . 0.0 109.745 173.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.0 tp -79.47 136.72 37.0 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.25 0.62 . . . . 0.0 110.009 169.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.6 t -155.07 147.53 24.07 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.564 0.746 . . . . 0.0 111.036 -176.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -71.23 130.62 41.89 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.879 -1.138 . . . . 0.0 110.532 171.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.7 p -73.6 157.59 87.45 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.231 1.412 . . . . 0.0 114.371 -168.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -69.98 -20.64 33.53 Favored 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 122.505 2.136 . . . . 0.0 112.12 169.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.27 4.79 8.06 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.904 1.681 . . . . 0.0 114.882 179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.36 -36.86 81.36 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.773 -1.204 . . . . 0.0 112.879 172.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -76.78 -40.11 49.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.791 0.836 . . . . 0.0 113.085 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -158.57 158.4 33.86 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.067 1.747 . . . . 0.0 110.756 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -71.89 74.94 0.89 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.818 1.247 . . . . 0.0 112.24 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -71.63 -21.69 61.8 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.911 1.684 . . . . 0.0 114.11 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.5 mt -67.22 152.57 45.5 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.041 1.336 . . . . 0.0 112.879 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -68.88 163.39 24.44 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.153 1.381 . . . . 0.0 112.999 175.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -68.87 122.43 18.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.686 0.794 . . . . 0.0 111.249 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.1 82.98 6.06 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.128 0.971 . . . . 0.0 111.483 -175.448 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.7 pt -62.9 148.15 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.918 0.887 . . . . 0.0 111.782 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -82.37 -25.2 34.02 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.679 0.791 . . . . 0.0 112.652 173.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.4 m -68.28 139.83 55.97 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.908 1.283 . . . . 0.0 112.865 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 24.7 t -76.43 161.61 28.53 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.189 0.996 . . . . 0.0 112.084 171.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.8 m -73.28 59.85 0.58 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.692 1.597 . . . . 0.0 111.341 169.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.6 ptm -80.73 5.25 16.32 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.442 1.897 . . . . 0.0 115.539 -169.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 49.5 p-10 -68.7 -12.19 61.11 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -148.86 142.95 25.93 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.393 1.877 . . . . 0.0 110.515 169.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -155.03 146.86 23.41 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.623 1.169 . . . . 0.0 112.625 -176.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.4 tp -145.07 126.29 14.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.77 2.028 . . . . 0.0 108.603 168.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -71.6 -49.48 39.91 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -164.71 161.21 20.54 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.903 1.681 . . . . 0.0 111.736 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.0 mt -75.22 154.95 37.32 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.939 0.896 . . . . 0.0 110.649 168.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -64.52 146.22 54.92 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 113.21 0.818 . . . . 0.0 113.21 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.1 p-10 -92.24 -17.8 24.31 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.344 1.458 . . . . 0.0 112.932 169.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 81.0 mt -71.46 146.54 48.56 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.965 1.306 . . . . 0.0 112.267 177.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.76 150.0 49.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.442 0.697 . . . . 0.0 111.733 172.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.2 m -75.57 -11.04 59.94 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 87.5 mt -71.92 146.16 48.0 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.003 1.321 . . . . 0.0 111.969 174.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 29.3 t -65.46 -21.85 66.69 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.279 1.032 . . . . 0.0 113.616 177.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -64.82 -30.35 71.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.825 1.65 . . . . 0.0 114.219 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 51.2 t0 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 125.23 1.412 . . . . 0.0 113.18 -178.742 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.602 0 N-CA-C 111.931 -0.468 . . . . 0.0 111.931 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.8 mmm -70.32 155.85 92.79 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 123.95 0.9 . . . . 0.0 112.706 177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -60.84 161.47 21.68 Favored 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 123.499 2.799 . . . . 0.0 113.987 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -58.03 151.15 60.0 Favored 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 123.645 2.897 . . . . 0.0 113.659 175.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -68.64 151.67 74.86 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.442 2.762 . . . . 0.0 112.569 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.72 37.06 0.17 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.713 1.605 . . . . 0.0 114.183 -178.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -78.73 45.16 0.58 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.35 1.86 . . . . 0.0 113.05 -176.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 mt -128.41 135.66 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 125.098 1.359 . . . . 0.0 110.51 -170.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -134.37 133.33 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.434 1.494 . . . . 0.0 111.883 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -75.05 142.15 43.78 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.121 0.969 . . . . 0.0 110.767 174.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m -141.55 156.77 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.807 1.643 . . . . 0.0 111.223 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.75 124.77 50.44 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.376 1.07 . . . . 0.0 110.269 171.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mt -112.46 123.76 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.334 1.054 . . . . 0.0 110.761 -170.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -79.55 144.34 34.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 112.817 174.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -154.65 143.29 14.65 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.777 1.631 . . . . 0.0 110.359 169.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -63.88 142.1 80.73 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.592 2.195 . . . . 0.0 113.6 -173.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.52 70.94 Favored Glycine 0 CA--C 1.539 1.533 0 N-CA-C 115.378 0.911 . . . . 0.0 115.378 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.16 154.91 46.1 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.259 1.424 . . . . 0.0 112.558 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -70.15 151.71 95.91 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 123.692 0.797 . . . . 0.0 111.177 169.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -59.43 130.64 36.6 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.502 2.135 . . . . 0.0 113.377 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -80.22 117.9 21.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.544 1.137 . . . . 0.0 110.637 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt -79.73 130.84 35.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 168.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.5 ptm -154.57 179.51 8.97 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.296 1.038 . . . . 0.0 111.226 171.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -122.25 125.74 46.7 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.137 0.975 . . . . 0.0 111.753 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.4 mt -89.78 116.74 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 C-N-CA 125.638 1.575 . . . . 0.0 108.932 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -89.9 113.25 24.83 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.088 1.355 . . . . 0.0 109.715 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -69.61 -11.7 61.05 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -88.97 -15.99 32.84 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.51 1.124 . . . . 0.0 113.79 170.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -79.06 149.04 72.73 Favored Pre-proline 0 N--CA 1.481 1.103 0 CA-C-N 119.831 1.196 . . . . 0.0 112.203 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.48 146.25 84.64 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.899 2.4 . . . . 0.0 110.984 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 mt -63.49 -27.94 69.62 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 118.529 -0.748 . . . . 0.0 112.264 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.5 t -59.0 -45.99 89.29 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.663 1.119 . . . . 0.0 112.423 171.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.48 99.25 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.584 -0.697 . . . . 0.0 112.078 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 53.3 mt -65.18 -49.02 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.595 0.758 . . . . 0.0 110.877 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.7 mt -61.74 -36.31 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.122 0.969 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.31 -43.62 92.63 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.114 0.87 . . . . 0.0 112.21 170.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -66.94 -27.53 67.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.362 1.065 . . . . 0.0 113.079 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 16.0 t -68.37 -57.48 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 CA-C-N 119.576 1.08 . . . . 0.0 110.358 169.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.6 m -60.98 -40.86 95.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.259 1.024 . . . . 0.0 112.522 -173.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -61.12 -27.66 68.54 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.45 -23.68 68.71 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.391 0.996 . . . . 0.0 114.413 174.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -116.27 16.03 15.85 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.802 1.641 . . . . 0.0 113.146 172.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 m 55.22 26.6 8.62 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.977 1.711 . . . . 0.0 114.557 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.2 mt -73.57 125.33 27.73 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.079 1.352 . . . . 0.0 111.164 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.6 155.7 37.55 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.404 1.081 . . . . 0.0 112.507 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 49.46 71.6 0.37 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.62 1.968 . . . . 0.0 113.144 173.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 -60.85 -16.99 47.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.472 1.109 . . . . 0.0 112.944 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -52.07 -29.36 21.07 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.155 1.782 . . . . 0.0 113.101 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -75.51 -15.24 60.42 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.12 160.74 14.6 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -167.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.68 150.21 38.37 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.995 2.118 . . . . 0.0 110.127 169.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.05 154.48 28.11 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 166.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -147.43 147.13 29.9 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.676 1.19 . . . . 0.0 110.456 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 -67.98 132.87 48.1 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.448 -0.783 . . . . 0.0 110.945 171.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.94 -19.22 60.75 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -65.58 166.24 10.93 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.717 1.207 . . . . 0.0 112.659 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.8 p -60.76 -16.28 38.6 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.085 1.354 . . . . 0.0 114.611 -176.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 79.4 p -62.29 -31.96 72.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.074 1.35 . . . . 0.0 113.232 170.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 51.6 30.86 7.0 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.157 1.783 . . . . 0.0 114.547 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -64.75 127.4 31.4 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 120.885 -1.135 . . . . 0.0 111.819 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -68.3 141.96 55.69 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.943 -0.473 . . . . 0.0 110.453 169.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 40.2 mm -78.08 132.26 32.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.884 0.874 . . . . 0.0 110.443 176.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.5 p -139.4 164.94 28.53 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 111.232 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -63.75 -6.76 6.13 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.802 1.241 . . . . 0.0 113.608 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -107.31 -8.08 16.49 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.169 1.788 . . . . 0.0 114.021 176.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -134.02 -5.28 2.74 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -55.9 -23.81 33.68 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -62.05 -21.72 65.15 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.251 1.42 . . . . 0.0 113.272 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -74.63 -14.17 60.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.012 0.925 . . . . 0.0 112.999 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.2 mt -71.55 130.61 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.046 0.938 . . . . 0.0 109.428 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -123.08 168.89 11.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.093 1.757 . . . . 0.0 112.255 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -60.86 123.41 17.46 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.768 -0.583 . . . . 0.0 110.942 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.71 11.3 64.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.268 1.413 . . . . 0.0 115.557 -174.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.2 m -65.73 131.87 47.37 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.704 1.752 . . . . 0.0 111.058 176.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mt -87.27 121.65 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -118.28 178.79 4.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.597 1.959 . . . . 0.0 110.551 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -144.44 136.32 26.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 126.759 2.023 . . . . 0.0 109.936 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.7 tp -82.77 138.15 34.12 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.131 0.572 . . . . 0.0 109.885 169.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.3 t -154.77 151.3 28.52 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.996 0.918 . . . . 0.0 110.409 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.4 p -68.9 131.81 45.7 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.89 -1.131 . . . . 0.0 110.396 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.8 t -62.08 153.42 74.09 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.808 2.043 . . . . 0.0 112.79 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -71.91 -16.45 29.3 Favored 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 122.945 2.43 . . . . 0.0 113.091 168.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -114.72 -32.15 5.92 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.524 1.53 . . . . 0.0 114.02 -177.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 56.29 -148.69 0.48 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.73 1.612 . . . . 0.0 113.001 172.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -63.28 -13.21 35.88 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -177.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -77.95 -9.86 59.3 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 171.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 42.5 tp60 -63.72 120.46 11.87 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.427 1.091 . . . . 0.0 111.873 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -82.03 -39.44 23.52 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 77.5 mt -101.15 134.61 43.91 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.425 1.49 . . . . 0.0 112.695 -172.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -137.25 22.78 2.99 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.531 1.933 . . . . 0.0 111.868 -177.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.52 156.41 38.04 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.098 2.559 . . . . 0.0 109.793 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 16.0 tpt85 -76.35 98.19 4.45 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.259 -0.9 . . . . 0.0 110.279 175.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 49.6 mm -70.82 106.06 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.917 0.887 . . . . 0.0 109.842 174.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -160.92 163.26 32.02 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.607 1.963 . . . . 0.0 110.99 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 46.9 t -74.17 -42.04 60.52 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.883 0.873 . . . . 0.0 111.156 169.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 28.2 t -76.75 166.33 23.51 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.202 1.401 . . . . 0.0 112.108 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.8 m -64.46 -30.48 71.52 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.133 -0.979 . . . . 0.0 112.749 170.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -160.04 157.55 28.86 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.908 1.683 . . . . 0.0 111.5 175.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 46.3 p-10 -132.37 -4.3 3.4 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.049 1.339 . . . . 0.0 114.559 -178.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 130.75 43.9 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.664 1.186 . . . . 0.0 112.993 -175.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -164.12 164.76 22.7 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.997 2.119 . . . . 0.0 111.2 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.5 pp -72.96 -23.52 60.67 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -173.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -79.02 157.82 28.01 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.21 1.004 . . . . 0.0 112.814 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.2 133.41 52.8 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.614 0.766 . . . . 0.0 112.265 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 70.1 mt -88.81 159.38 17.77 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.879 1.272 . . . . 0.0 112.458 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -147.73 145.13 28.73 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.79 1.636 . . . . 0.0 111.008 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -69.28 157.02 37.8 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.163 0.985 . . . . 0.0 112.761 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 86.8 mt -71.16 143.52 50.5 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.694 1.198 . . . . 0.0 112.223 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -72.98 -20.87 60.94 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 94.4 p -155.8 165.4 36.62 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.186 1.794 . . . . 0.0 111.181 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 94.6 mt -131.01 153.96 48.69 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.392 1.477 . . . . 0.0 111.779 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.0 m -74.04 -3.54 29.99 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.251 1.42 . . . . 0.0 114.798 -178.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -143.66 143.87 31.64 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.37 1.868 . . . . 0.0 111.027 -177.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 . . . . . 0 C--O 1.253 1.248 0 C-N-CA 126.279 1.832 . . . . 0.0 113.404 177.281 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt -66.64 141.23 96.84 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.186 0.995 . . . . 0.0 112.034 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -58.79 154.07 46.08 Favored 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.401 2.734 . . . . 0.0 114.185 175.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.18 158.33 55.27 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.56 2.84 . . . . 0.0 112.857 176.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -65.61 156.92 61.23 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.596 2.864 . . . . 0.0 113.053 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -150.78 175.01 12.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.881 1.672 . . . . 0.0 111.623 -177.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -75.86 55.51 0.89 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.43 1.492 . . . . 0.0 112.406 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.7 mt -133.18 136.89 54.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 126.329 1.852 . . . . 0.0 109.418 -172.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.4 m -132.51 131.87 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.988 1.315 . . . . 0.0 111.646 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.22 143.6 47.07 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.738 0.815 . . . . 0.0 110.635 172.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m -139.65 150.67 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.983 1.713 . . . . 0.0 110.988 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.37 109.54 19.23 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.558 1.143 . . . . 0.0 109.751 173.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.8 mt -99.8 124.59 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 123.848 0.859 . . . . 0.0 109.988 -173.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -93.29 149.37 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.254 1.422 . . . . 0.0 112.612 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -153.18 142.89 15.04 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.957 1.703 . . . . 0.0 110.276 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -59.99 138.9 85.01 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.698 2.265 . . . . 0.0 113.77 -175.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.85 12.8 75.08 Favored Glycine 0 CA--C 1.539 1.584 0 N-CA-C 115.436 0.934 . . . . 0.0 115.436 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.41 156.84 47.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.195 1.398 . . . . 0.0 112.912 -177.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -72.38 155.55 91.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 124.368 1.067 . . . . 0.0 111.15 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -65.89 129.26 21.61 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.554 2.169 . . . . 0.0 112.06 -177.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -79.42 106.05 11.17 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.321 1.448 . . . . 0.0 109.853 174.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.6 mt -75.38 126.89 31.92 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.338 0.655 . . . . 0.0 109.453 169.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.0 ptm -153.13 177.76 10.47 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.213 1.005 . . . . 0.0 111.462 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -117.06 129.93 56.33 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.002 0.921 . . . . 0.0 112.023 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.0 mt -92.39 109.28 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.343 1.457 . . . . 0.0 108.462 170.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -83.98 119.56 25.06 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -66.65 -11.18 52.75 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -176.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -86.76 -23.56 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.011 1.324 . . . . 0.0 113.856 171.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -78.56 141.31 60.5 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.454 1.024 . . . . 0.0 111.372 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.71 144.28 59.27 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.278 2.652 . . . . 0.0 111.628 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.71 -31.01 71.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.377 -0.82 . . . . 0.0 112.762 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -59.18 -46.83 87.39 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.874 1.215 . . . . 0.0 111.98 174.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.6 -39.64 91.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.589 -0.694 . . . . 0.0 112.329 176.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.81 -48.67 85.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.491 0.716 . . . . 0.0 110.513 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -62.7 -37.1 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.71 1.204 . . . . 0.0 110.977 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.53 -39.72 84.86 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.545 0.738 . . . . 0.0 112.038 170.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -73.26 -24.73 60.49 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.711 1.204 . . . . 0.0 113.762 173.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 32.3 t -69.31 -61.23 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.644 1.111 . . . . 0.0 110.587 169.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.8 p -64.08 -34.32 77.77 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.797 0.839 . . . . 0.0 112.624 -170.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.71 -29.24 69.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.879 0.872 . . . . 0.0 112.906 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.79 -23.54 67.4 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.406 1.003 . . . . 0.0 114.171 174.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -115.0 11.53 16.51 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.71 . . . . 0.0 113.288 172.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.65 29.34 13.48 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.088 1.755 . . . . 0.0 114.282 -176.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.0 mt -79.1 131.23 36.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.22 1.408 . . . . 0.0 110.705 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.89 164.43 22.64 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.697 1.199 . . . . 0.0 113.623 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 53.14 68.87 0.77 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.403 1.881 . . . . 0.0 113.749 170.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -62.65 -21.01 65.37 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.229 -0.92 . . . . 0.0 113.068 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -54.78 -31.01 58.25 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.737 1.615 . . . . 0.0 113.117 171.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -77.12 -21.0 54.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.791 0.837 . . . . 0.0 112.68 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.71 158.96 15.28 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 122.731 1.253 . . . . 0.0 114.002 -169.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.9 154.07 39.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.058 2.543 . . . . 0.0 109.585 174.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 34.1 mt -86.4 154.05 21.47 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 167.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -144.92 145.76 31.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.354 1.061 . . . . 0.0 110.561 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -63.74 132.1 49.93 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 122.014 -0.429 . . . . 0.0 111.755 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -108.45 -28.84 9.13 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.842 0.857 . . . . 0.0 113.162 176.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -69.25 -36.99 77.71 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 41.6 t -160.93 151.49 18.13 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.778 1.231 . . . . 0.0 112.676 -178.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.8 m 59.75 -17.29 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 118.983 2.957 . . . . 0.0 118.983 169.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.0 m120 57.04 34.86 25.59 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.94 1.696 . . . . 0.0 115.172 173.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -67.07 136.76 55.7 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.219 -0.926 . . . . 0.0 110.733 169.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -71.67 145.11 49.1 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.085 0.554 . . . . 0.0 110.436 169.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.6 mm -83.6 135.05 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.847 0.859 . . . . 0.0 110.52 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.6 p -145.52 168.0 21.65 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.815 2.046 . . . . 0.0 109.119 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -62.0 -16.72 53.65 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 121.123 -0.985 . . . . 0.0 113.171 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -88.33 -34.56 17.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.664 1.586 . . . . 0.0 113.529 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -92.84 -25.43 18.11 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -57.27 -25.17 58.78 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -171.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -67.87 -15.3 63.56 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.354 1.062 . . . . 0.0 113.51 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -78.87 -16.19 57.37 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.5 mt -67.08 139.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.743 1.217 . . . . 0.0 110.09 175.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -126.79 161.63 27.74 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.405 1.482 . . . . 0.0 111.703 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -61.66 119.61 9.01 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.894 -0.504 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.47 10.71 60.29 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 125.333 1.444 . . . . 0.0 115.625 -174.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.9 m -63.66 132.44 51.09 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.615 1.707 . . . . 0.0 111.709 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.3 mt -86.62 125.33 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.566 0.747 . . . . 0.0 109.388 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -122.29 172.37 8.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.329 1.852 . . . . 0.0 111.156 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtm105 -131.09 143.73 50.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.531 1.932 . . . . 0.0 110.584 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.36 136.63 34.28 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 166.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.0 t -157.24 151.95 25.54 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.728 0.811 . . . . 0.0 111.044 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.8 p -72.23 136.66 46.43 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.674 -1.266 . . . . 0.0 110.846 171.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 31.4 t -63.39 145.51 97.06 Favored Pre-proline 0 CA--C 1.542 0.654 0 C-N-CA 125.516 1.527 . . . . 0.0 113.164 -173.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -63.56 -11.85 28.18 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.212 2.608 . . . . 0.0 113.525 171.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.88 -12.53 61.31 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 172.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -64.39 149.61 48.01 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.107 0.867 . . . . 0.0 112.615 177.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -69.15 157.36 37.04 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.729 1.212 . . . . 0.0 113.908 -173.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -145.91 157.95 43.88 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.033 1.733 . . . . 0.0 111.941 177.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -70.47 160.45 32.37 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -177.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -76.41 160.01 29.94 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.458 1.103 . . . . 0.0 111.495 168.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.2 mt -76.18 147.91 38.11 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.287 1.035 . . . . 0.0 112.277 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -86.83 8.1 24.29 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -68.95 159.28 33.0 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.67 1.188 . . . . 0.0 114.113 -175.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -143.01 142.39 31.58 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.502 1.921 . . . . 0.0 110.987 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 93.8 mt -72.18 110.94 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 169.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -83.64 -23.43 31.81 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 8.0 t -81.74 -178.5 7.0 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.425 1.49 . . . . 0.0 112.796 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 47.8 t -62.8 158.02 19.83 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.995 1.318 . . . . 0.0 112.485 171.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 65.2 m -71.55 -14.26 62.04 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 177.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.2 ptm -68.08 159.95 29.87 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.179 0.992 . . . . 0.0 112.927 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 52.3 p30 -145.73 179.09 7.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.117 1.367 . . . . 0.0 112.077 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.06 -3.3 31.74 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -173.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.65 144.23 55.62 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.46 1.104 . . . . 0.0 112.138 -177.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.6 mt -68.51 154.78 41.19 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.383 1.073 . . . . 0.0 112.513 178.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -77.68 47.82 0.64 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.742 1.617 . . . . 0.0 113.234 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.74 148.13 52.33 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.637 1.175 . . . . 0.0 112.514 177.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.9 mt -137.87 154.66 49.45 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.881 1.673 . . . . 0.0 111.655 -177.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -152.25 143.28 23.1 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.886 1.674 . . . . 0.0 110.915 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -84.86 106.86 16.7 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.867 0.867 . . . . 0.0 110.803 171.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 11.1 mp -83.15 -11.09 58.25 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.383 1.073 . . . . 0.0 113.593 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.65 136.49 57.03 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.049 0.94 . . . . 0.0 112.613 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.3 p -81.14 -24.66 37.47 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.633 1.173 . . . . 0.0 114.063 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.9 pp -72.16 153.72 41.47 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.585 1.154 . . . . 0.0 113.074 -178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 90.7 p -137.76 3.65 2.5 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.194 1.398 . . . . 0.0 114.206 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -70.1 163.07 27.02 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.308 1.443 . . . . 0.0 113.918 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.333 1.453 . . . . 0.0 112.831 169.571 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.59 0 N-CA-C 111.834 -0.506 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ptp -67.57 158.24 83.28 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 124.0 0.92 . . . . 0.0 112.82 177.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.97 156.79 42.1 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.264 2.643 . . . . 0.0 114.132 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -61.5 163.89 16.86 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 123.595 2.863 . . . . 0.0 114.145 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.43 156.26 26.96 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.91 3.073 . . . . 0.0 113.873 172.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.37 142.64 58.31 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 47.8 p30 -142.64 19.28 2.02 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.111 1.764 . . . . 0.0 113.19 -174.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.5 mt -125.94 137.55 57.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.072 1.749 . . . . 0.0 109.619 178.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -130.9 133.51 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.114 1.366 . . . . 0.0 112.209 -178.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -71.29 141.71 50.5 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.187 0.995 . . . . 0.0 111.518 171.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -141.28 153.05 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.46 1.504 . . . . 0.0 111.838 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.68 116.52 28.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.945 1.298 . . . . 0.0 109.966 173.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.9 mt -107.41 120.75 59.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.162 0.985 . . . . 0.0 110.607 -170.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -81.16 149.08 29.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.217 1.407 . . . . 0.0 112.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -152.53 142.88 15.26 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.798 1.639 . . . . 0.0 109.97 169.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -62.14 136.47 60.7 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.512 2.141 . . . . 0.0 113.416 -172.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.09 12.53 71.92 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 115.214 0.845 . . . . 0.0 115.214 -179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.41 154.32 50.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.098 1.359 . . . . 0.0 112.892 -177.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -68.83 153.8 95.56 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 124.433 1.093 . . . . 0.0 111.633 172.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -66.07 125.6 14.39 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.62 2.213 . . . . 0.0 111.68 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -77.74 110.64 12.77 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 110.415 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -75.94 127.09 32.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.294 0.638 . . . . 0.0 109.86 169.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 21.9 ptm -151.72 -178.0 6.45 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.259 1.024 . . . . 0.0 111.837 173.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -120.5 132.6 55.27 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.421 1.088 . . . . 0.0 112.117 176.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.3 mt -96.72 111.87 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.416 1.486 . . . . 0.0 108.836 171.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.69 115.44 20.95 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -67.23 -10.77 53.97 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -90.16 -22.55 21.67 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.743 1.217 . . . . 0.0 113.866 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -87.37 145.56 37.89 Favored Pre-proline 0 N--CA 1.482 1.152 0 CA-C-N 119.667 1.122 . . . . 0.0 111.336 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.36 146.42 56.4 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.272 2.648 . . . . 0.0 112.74 -173.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.88 -31.6 71.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.343 0.657 . . . . 0.0 112.533 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.3 m -60.27 -42.2 94.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.24 0.927 . . . . 0.0 112.471 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.07 78.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.194 0.598 . . . . 0.0 111.914 175.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.52 -49.05 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.288 0.635 . . . . 0.0 110.751 174.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 56.4 mt -61.35 -37.54 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.04 0.936 . . . . 0.0 111.146 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -59.33 -45.98 89.86 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.031 0.832 . . . . 0.0 111.974 170.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -68.89 -26.11 64.94 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.831 1.252 . . . . 0.0 113.094 177.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 67.1 t -68.01 -60.83 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 119.185 0.902 . . . . 0.0 109.505 168.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.2 m -58.02 -36.54 72.86 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.34 1.456 . . . . 0.0 113.381 -170.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -59.18 -27.9 66.12 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.194 0.998 . . . . 0.0 113.526 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.01 -27.28 73.24 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.326 -0.859 . . . . 0.0 114.205 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -106.48 13.81 27.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.454 1.502 . . . . 0.0 112.756 173.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.2 m 55.56 27.46 10.42 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.128 1.771 . . . . 0.0 114.211 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.2 mt -75.9 114.31 14.38 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.64 1.176 . . . . 0.0 110.909 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.75 162.0 30.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.357 1.063 . . . . 0.0 112.049 173.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 54.37 55.69 7.8 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.403 1.481 . . . . 0.0 113.332 176.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -57.76 -17.74 17.41 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 113.368 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -56.37 -28.58 59.62 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.11 1.364 . . . . 0.0 112.966 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -78.32 -14.86 59.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.158 0.983 . . . . 0.0 112.73 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -94.42 157.75 15.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.56 1.144 . . . . 0.0 114.054 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.51 145.65 31.14 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.13 2.172 . . . . 0.0 109.715 176.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -79.95 145.32 32.67 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.532 0.682 . . . . 0.0 109.593 168.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -134.06 146.85 50.71 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.371 1.869 . . . . 0.0 108.83 -176.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -72.69 146.45 46.49 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.466 -0.771 . . . . 0.0 112.578 176.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -129.21 -27.57 2.45 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.61 1.164 . . . . 0.0 112.325 169.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -72.86 -51.11 20.04 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.087 0.955 . . . . 0.0 111.513 169.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.9 t -85.59 -177.11 6.33 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.557 1.143 . . . . 0.0 112.354 171.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 t -63.66 170.05 3.55 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.263 1.025 . . . . 0.0 111.745 169.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -70.01 42.11 0.05 Allowed 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 127.189 2.196 . . . . 0.0 116.599 -168.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -74.4 112.85 10.98 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.877 1.271 . . . . 0.0 111.512 171.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -61.47 136.57 58.07 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.842 -0.536 . . . . 0.0 110.421 169.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.7 mm -75.11 130.11 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 123.438 0.695 . . . . 0.0 110.333 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.0 p -140.22 164.12 30.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.888 1.675 . . . . 0.0 110.845 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -60.6 -15.3 26.64 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.218 -0.926 . . . . 0.0 113.056 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -89.26 -15.03 34.52 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.078 1.751 . . . . 0.0 114.671 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -135.41 -7.21 2.25 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -174.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -57.16 -21.22 31.28 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -61.22 -21.58 63.98 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.914 1.286 . . . . 0.0 113.173 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.18 -13.97 60.5 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.201 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 80.4 mt -71.32 131.94 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.334 1.054 . . . . 0.0 109.778 174.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -116.23 170.37 8.58 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 112.507 171.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -58.79 128.58 37.92 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.912 -0.493 . . . . 0.0 111.013 169.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.1 9.46 76.84 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 124.961 1.267 . . . . 0.0 115.251 -176.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.7 m -64.96 130.19 42.48 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.546 1.673 . . . . 0.0 111.326 177.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.6 124.48 40.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.436 0.694 . . . . 0.0 109.321 170.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -122.38 177.79 5.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.991 2.116 . . . . 0.0 110.28 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -144.53 136.73 26.26 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.75 2.02 . . . . 0.0 110.019 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.0 tp -82.32 137.44 34.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.341 0.656 . . . . 0.0 109.999 169.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.5 t -157.26 159.45 37.62 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.168 0.987 . . . . 0.0 110.555 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.2 p -72.08 144.69 48.6 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.72 -1.238 . . . . 0.0 110.548 169.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.6 t -56.7 149.06 43.66 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 125.729 1.612 . . . . 0.0 113.029 -174.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -65.57 -17.86 58.02 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 122.896 2.397 . . . . 0.0 113.136 173.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -105.58 -54.71 2.44 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.933 1.293 . . . . 0.0 112.92 177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 56.52 -62.72 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 128.208 2.603 . . . . 0.0 115.623 -170.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 -83.68 150.36 25.91 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.688 1.595 . . . . 0.0 112.801 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.2 141.02 49.03 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.796 0.838 . . . . 0.0 112.506 178.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -155.64 151.05 27.0 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.563 1.545 . . . . 0.0 111.481 176.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -91.38 -33.16 15.38 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.175 1.39 . . . . 0.0 112.338 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mp -77.97 147.97 34.66 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.285 1.434 . . . . 0.0 112.292 -174.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -155.32 159.58 40.08 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.341 1.856 . . . . 0.0 110.846 174.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -157.5 169.42 24.74 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.745 1.218 . . . . 0.0 112.536 -176.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 23.2 tpp85 -61.41 143.34 56.0 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.862 1.265 . . . . 0.0 111.52 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -56.14 135.11 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.923 1.289 . . . . 0.0 111.269 -177.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -130.8 176.49 8.16 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.49 1.916 . . . . 0.0 112.465 -171.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 19.6 m -59.32 155.71 14.03 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.19 1.396 . . . . 0.0 113.281 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.2 m -73.82 43.19 0.15 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.604 1.962 . . . . 0.0 115.532 -171.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.6 t -66.46 148.11 52.34 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.622 1.169 . . . . 0.0 111.826 172.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 61.1 mtt -142.42 152.99 43.35 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.312 1.445 . . . . 0.0 112.251 -175.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -80.02 -1.41 39.64 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.755 1.222 . . . . 0.0 114.134 178.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 58.64 22.56 10.0 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.422 1.889 . . . . 0.0 114.805 -174.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -152.64 165.99 33.52 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.008 2.123 . . . . 0.0 111.556 177.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.3 tp -146.68 127.82 14.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.835 1.254 . . . . 0.0 110.657 172.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -144.36 142.64 30.51 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.628 1.571 . . . . 0.0 110.664 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -82.78 131.51 35.2 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.675 0.79 . . . . 0.0 111.544 173.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.0 pp -154.66 160.48 41.44 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.191 1.396 . . . . 0.0 112.302 176.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -132.44 158.09 42.92 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.793 1.637 . . . . 0.0 111.575 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -152.68 -57.09 0.13 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.294 1.438 . . . . 0.0 110.456 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 28.8 tp 62.5 -14.89 0.06 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 128.636 2.775 . . . . 0.0 116.706 170.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.84 143.01 55.61 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.706 1.202 . . . . 0.0 112.53 175.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 84.1 p -157.06 167.2 31.14 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.234 1.414 . . . . 0.0 111.986 -176.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.16 133.86 56.49 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.914 1.286 . . . . 0.0 112.0 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 67.1 m -67.85 148.41 51.21 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.026 0.93 . . . . 0.0 113.118 -178.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -69.73 171.31 9.32 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.935 1.294 . . . . 0.0 113.509 173.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 43.3 t0 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 126.191 1.796 . . . . 0.0 110.844 169.142 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.562 0 N-CA-C 111.972 -0.451 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.29 149.79 97.34 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.173 0.989 . . . . 0.0 112.715 178.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -67.77 159.69 51.62 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 C-N-CA 123.648 2.899 . . . . 0.0 112.911 176.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -65.24 155.37 68.87 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 123.498 2.798 . . . . 0.0 112.58 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -68.26 149.02 75.54 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 123.514 2.809 . . . . 0.0 113.113 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.87 71.12 3.38 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.187 1.395 . . . . 0.0 112.138 178.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.53 67.22 1.48 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.787 1.635 . . . . 0.0 111.205 174.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.2 mt -108.39 137.71 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.946 1.698 . . . . 0.0 110.454 -177.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -132.08 134.29 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.656 1.583 . . . . 0.0 111.413 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.1 143.03 35.93 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.02 0.928 . . . . 0.0 110.992 174.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.93 157.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.737 1.615 . . . . 0.0 111.459 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.21 115.91 26.85 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.637 1.175 . . . . 0.0 110.033 172.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.1 mt -104.65 125.16 59.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 123.833 0.853 . . . . 0.0 110.333 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -89.16 144.34 26.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.887 1.275 . . . . 0.0 112.316 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -153.79 143.99 15.59 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.104 1.762 . . . . 0.0 110.068 173.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -62.79 145.06 94.7 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.724 2.283 . . . . 0.0 113.985 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 11.34 75.08 Favored Glycine 0 CA--C 1.539 1.552 0 N-CA-C 115.484 0.954 . . . . 0.0 115.484 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.7 156.82 44.66 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.215 1.406 . . . . 0.0 112.64 -177.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -69.55 153.77 95.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 123.767 0.827 . . . . 0.0 111.314 169.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.74 128.98 28.76 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.516 2.144 . . . . 0.0 112.907 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -81.0 112.08 18.07 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.91 1.284 . . . . 0.0 110.365 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -76.64 127.5 32.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.455 0.702 . . . . 0.0 109.62 169.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -153.89 171.6 18.72 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.171 0.988 . . . . 0.0 111.538 177.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -114.85 124.54 52.0 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.796 0.838 . . . . 0.0 112.82 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.0 mt -91.6 110.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 125.705 1.602 . . . . 0.0 108.5 174.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -85.48 117.07 24.17 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.779 0.832 . . . . 0.0 109.259 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -67.23 -13.32 61.86 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -84.26 -23.14 30.51 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.613 1.165 . . . . 0.0 113.45 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -79.94 148.03 67.38 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 124.569 1.148 . . . . 0.0 111.926 177.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.58 141.25 49.78 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.748 2.299 . . . . 0.0 111.041 175.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.38 -31.63 70.53 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.002 0.521 . . . . 0.0 112.004 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -59.82 -42.64 93.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.211 0.914 . . . . 0.0 112.804 175.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.34 79.74 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.823 -0.548 . . . . 0.0 111.99 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.57 -48.18 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.669 0.787 . . . . 0.0 110.523 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -62.68 -35.76 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 124.075 0.95 . . . . 0.0 110.757 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -60.13 -44.09 95.18 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.401 1.001 . . . . 0.0 112.28 170.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -67.48 -34.02 76.31 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.421 1.088 . . . . 0.0 112.932 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.88 -53.17 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.917 0.887 . . . . 0.0 111.119 172.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 86.6 m -59.87 -42.57 94.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.819 0.848 . . . . 0.0 112.076 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.47 -27.89 68.89 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.641 0.776 . . . . 0.0 112.971 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.8 -23.64 65.67 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.457 1.027 . . . . 0.0 114.289 172.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -115.23 16.61 16.87 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.02 1.728 . . . . 0.0 113.161 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 56.29 25.14 9.0 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 126.049 1.739 . . . . 0.0 114.732 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.4 mt -75.13 122.89 24.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.236 1.414 . . . . 0.0 111.712 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 163.36 27.66 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.145 . . . . 0.0 112.168 171.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 53.06 52.95 12.77 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.454 1.501 . . . . 0.0 113.181 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -57.73 -24.76 58.53 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.146 0.979 . . . . 0.0 112.811 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -63.48 -12.71 33.96 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.321 1.448 . . . . 0.0 113.937 173.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -81.56 -17.45 48.36 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.309 -0.87 . . . . 0.0 112.739 168.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -94.98 160.96 14.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 122.637 1.208 . . . . 0.0 113.951 -169.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.66 152.51 42.51 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.721 2.409 . . . . 0.0 109.479 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.0 mt -82.81 155.59 24.11 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -143.4 144.03 31.88 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.442 1.097 . . . . 0.0 110.614 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -67.47 134.1 50.74 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 176.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.49 -32.02 8.72 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.104 0.962 . . . . 0.0 111.591 167.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -75.26 -49.17 20.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.078 0.951 . . . . 0.0 113.054 172.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -82.62 177.38 8.73 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.719 0.807 . . . . 0.0 112.12 173.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.3 t -74.95 59.42 0.91 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.155 1.782 . . . . 0.0 114.759 -169.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 59.12 21.26 9.24 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.604 1.962 . . . . 0.0 115.753 171.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -67.24 133.54 49.92 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.738 -1.227 . . . . 0.0 111.905 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -69.83 143.08 52.99 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.11 0.564 . . . . 0.0 110.056 169.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.4 mm -82.65 132.52 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.625 0.77 . . . . 0.0 110.725 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.0 p -148.9 172.3 14.91 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.244 2.217 . . . . 0.0 109.275 -174.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.58 -20.74 57.89 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.802 -1.186 . . . . 0.0 113.325 172.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.22 -18.8 23.83 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.528 1.531 . . . . 0.0 113.72 175.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -114.87 -19.27 11.06 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -174.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -61.14 -23.12 65.3 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.528 1.306 . . . . 0.0 114.528 -175.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -63.94 -22.83 67.1 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.949 1.3 . . . . 0.0 113.184 173.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -75.26 -13.6 60.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 112.864 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.1 mt -74.14 128.66 36.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.4 1.08 . . . . 0.0 109.514 172.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -113.5 173.67 6.29 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.415 1.486 . . . . 0.0 111.946 169.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -61.69 130.88 47.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.692 -0.63 . . . . 0.0 111.14 170.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.14 9.98 83.28 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 125.143 1.354 . . . . 0.0 115.646 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 88.7 m -65.95 131.74 46.96 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 119.637 1.719 . . . . 0.0 111.736 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 51.1 mt -85.34 127.73 39.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 123.574 0.75 . . . . 0.0 109.351 169.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.4 mt -124.05 171.78 9.49 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.841 2.056 . . . . 0.0 110.855 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -133.38 136.2 45.16 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 127.077 2.151 . . . . 0.0 110.229 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -82.27 137.57 34.81 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 168.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.8 t -156.76 150.09 24.25 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.776 0.83 . . . . 0.0 111.44 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.6 p -70.54 127.51 32.96 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.748 -1.22 . . . . 0.0 110.287 170.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.2 t -66.81 141.11 96.6 Favored Pre-proline 0 CA--C 1.537 0.46 0 C-N-CA 125.197 1.399 . . . . 0.0 112.703 -172.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -62.3 -25.96 76.88 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.416 2.077 . . . . 0.0 112.024 170.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -78.13 -11.92 59.95 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 176.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -14.1 62.4 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 120.29 1.404 . . . . 0.0 113.7 -178.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -64.9 -21.95 66.91 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.849 1.26 . . . . 0.0 112.907 170.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -98.93 5.64 47.15 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.728 1.611 . . . . 0.0 114.314 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -63.54 152.05 39.72 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.234 0.925 . . . . 0.0 112.874 177.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -136.81 165.24 26.4 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.912 1.685 . . . . 0.0 111.583 -176.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.1 mt -65.95 131.07 45.38 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.777 0.831 . . . . 0.0 111.856 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -158.55 165.2 35.09 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.931 1.692 . . . . 0.0 111.884 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -77.61 138.76 39.3 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.582 0.753 . . . . 0.0 112.558 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.41 138.51 41.74 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.567 1.147 . . . . 0.0 110.395 170.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -67.32 -49.8 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.763 0.825 . . . . 0.0 110.668 176.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -155.85 133.73 11.24 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.523 1.529 . . . . 0.0 110.44 171.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 39.2 m -80.92 -37.06 30.23 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.747 1.219 . . . . 0.0 113.285 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 33.8 t -160.58 155.32 23.98 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.107 1.363 . . . . 0.0 112.065 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 80.9 p -74.85 -20.33 59.8 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.38 1.072 . . . . 0.0 113.523 171.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 62.1 mtt -145.48 144.25 30.48 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.41 1.484 . . . . 0.0 112.201 -177.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -84.39 29.02 0.61 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.103 1.361 . . . . 0.0 113.361 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.81 141.77 51.34 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.721 1.209 . . . . 0.0 112.681 -177.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -78.06 140.65 39.12 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.355 1.062 . . . . 0.0 111.961 177.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.8 tp -78.59 150.19 32.8 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.752 1.221 . . . . 0.0 111.523 172.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -146.22 162.8 37.26 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.304 1.442 . . . . 0.0 111.765 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -147.79 161.26 41.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.21 1.404 . . . . 0.0 112.024 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 88.9 mt -73.13 -16.39 61.45 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -177.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.19 160.86 43.6 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.238 1.815 . . . . 0.0 112.406 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -76.2 157.87 32.24 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.424 1.09 . . . . 0.0 112.609 176.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.1 pp -69.78 -1.81 10.29 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -76.42 22.15 0.17 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.338 1.855 . . . . 0.0 114.975 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.0 m -63.41 -1.99 1.36 Allowed 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -172.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.43 -14.71 63.04 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.878 1.271 . . . . 0.0 113.195 169.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.4 p -65.73 158.57 27.19 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.721 1.208 . . . . 0.0 113.331 175.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -150.87 146.9 26.63 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.714 1.605 . . . . 0.0 111.342 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 125.226 1.41 . . . . 0.0 113.639 178.152 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.389 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptp -73.19 163.03 71.53 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 124.136 0.974 . . . . 0.0 112.304 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -57.74 149.03 71.16 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 123.238 2.625 . . . . 0.0 113.002 173.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.65 149.68 83.89 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.166 2.577 . . . . 0.0 113.256 -173.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -67.0 160.45 47.19 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.676 2.917 . . . . 0.0 111.19 171.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -152.19 153.82 34.58 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -172.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 50.51 31.34 5.47 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.338 1.855 . . . . 0.0 113.738 173.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.9 mt -60.21 133.3 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 125.197 1.399 . . . . 0.0 111.097 -174.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.9 m -134.22 131.3 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.005 1.322 . . . . 0.0 112.609 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -67.52 141.5 56.87 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.167 0.987 . . . . 0.0 110.952 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.1 m -142.03 153.55 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.797 1.239 . . . . 0.0 112.062 175.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.06 120.55 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.921 1.288 . . . . 0.0 109.602 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.0 mt -107.92 122.21 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.645 0.778 . . . . 0.0 110.593 -171.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -84.9 149.67 25.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.981 1.712 . . . . 0.0 113.187 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -156.74 142.2 12.58 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.038 1.735 . . . . 0.0 110.27 169.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -60.59 137.45 73.65 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.642 2.228 . . . . 0.0 113.506 -176.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.87 12.56 74.94 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.28 154.13 51.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.252 1.421 . . . . 0.0 112.61 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.07 152.82 92.75 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.659 0.784 . . . . 0.0 111.435 169.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -61.43 131.73 37.53 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.581 2.188 . . . . 0.0 113.063 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -82.77 109.05 16.58 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.105 0.962 . . . . 0.0 110.023 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.6 mt -74.83 132.04 41.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.41 0.684 . . . . 0.0 110.081 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ptp -154.02 179.97 8.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.218 1.007 . . . . 0.0 111.964 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -123.41 125.38 44.85 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.729 1.211 . . . . 0.0 111.338 171.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.6 mt -86.79 110.96 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 124.629 1.172 . . . . 0.0 108.891 172.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -82.99 121.59 27.2 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.152 0.981 . . . . 0.0 108.462 167.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -69.8 -10.38 58.19 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -86.38 -15.18 41.22 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.473 1.286 . . . . 0.0 114.473 169.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -87.79 140.72 31.39 Favored Pre-proline 0 N--CA 1.479 0.994 0 CA-C-N 120.071 1.305 . . . . 0.0 111.142 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 144.09 62.51 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.315 2.676 . . . . 0.0 111.443 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 mt -59.68 -33.4 71.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.94 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.57 -43.75 89.53 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.26 0.936 . . . . 0.0 112.637 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.73 -38.94 77.03 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.95 0.5 . . . . 0.0 112.147 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.87 -47.27 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.476 0.71 . . . . 0.0 110.422 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.1 mt -62.52 -36.24 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.903 1.281 . . . . 0.0 111.144 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -61.86 -39.55 92.27 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.954 0.797 . . . . 0.0 112.385 170.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -70.01 -27.09 64.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.987 0.915 . . . . 0.0 113.278 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.7 t -69.39 -57.37 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.58 1.082 . . . . 0.0 110.82 169.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.5 p -63.96 -34.41 77.91 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.499 0.72 . . . . 0.0 112.557 -169.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.99 -27.61 68.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.31 1.044 . . . . 0.0 113.064 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.53 -22.98 70.12 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.305 0.955 . . . . 0.0 114.045 174.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -120.57 13.79 11.76 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.136 1.774 . . . . 0.0 113.106 176.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.4 m 55.77 29.22 13.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.249 1.82 . . . . 0.0 114.515 -178.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.91 128.2 33.17 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.659 1.183 . . . . 0.0 110.403 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.49 165.7 20.98 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.744 1.218 . . . . 0.0 113.35 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 53.87 63.1 2.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.121 1.769 . . . . 0.0 113.746 170.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -60.39 -19.98 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -177.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -57.32 -26.23 60.59 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.24 1.416 . . . . 0.0 113.193 171.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -81.37 -19.6 42.34 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.989 0.916 . . . . 0.0 112.782 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -92.09 157.88 16.51 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.583 1.182 . . . . 0.0 113.943 -169.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.32 154.38 41.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.014 2.526 . . . . 0.0 109.736 175.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.9 mt -89.69 151.19 21.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 167.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -142.05 147.0 36.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.636 1.174 . . . . 0.0 110.137 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 -65.18 143.21 58.0 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.36 -25.38 1.74 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.03 1.332 . . . . 0.0 113.308 174.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -73.21 -9.61 58.89 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.389 1.076 . . . . 0.0 112.97 168.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.5 t -144.47 -171.38 3.58 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.431 2.292 . . . . 0.0 109.961 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.7 m -54.79 153.03 6.48 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.397 1.079 . . . . 0.0 112.173 173.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -71.0 48.83 0.12 Allowed 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 126.963 2.105 . . . . 0.0 115.657 -169.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -70.98 132.94 45.94 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.318 -1.489 . . . . 0.0 111.508 171.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -74.63 141.12 44.67 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.308 0.643 . . . . 0.0 111.305 171.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 35.0 mm -80.3 132.81 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.37 1.068 . . . . 0.0 110.339 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 19.5 p -140.42 163.67 32.19 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.746 1.618 . . . . 0.0 111.023 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -61.27 -12.64 14.16 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.088 -1.008 . . . . 0.0 113.197 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -94.62 -15.24 24.18 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.156 1.782 . . . . 0.0 114.472 176.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -132.93 -7.73 3.09 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -176.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.95 -22.73 16.02 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -64.87 -18.26 65.01 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.569 1.548 . . . . 0.0 113.556 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -78.98 -14.54 59.15 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.097 0.959 . . . . 0.0 113.579 176.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.51 141.79 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 124.944 1.298 . . . . 0.0 110.101 174.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -127.4 160.87 30.1 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.212 1.405 . . . . 0.0 111.723 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -60.08 124.46 20.29 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.806 -0.559 . . . . 0.0 111.326 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.08 9.04 68.11 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.168 1.366 . . . . 0.0 115.174 -174.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 96.2 m -65.03 129.06 38.33 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.581 1.69 . . . . 0.0 111.105 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.0 mt -83.46 123.19 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 169.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -116.26 176.19 5.21 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.712 2.005 . . . . 0.0 110.161 174.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 33.5 ttp85 -143.94 135.94 26.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 126.367 1.867 . . . . 0.0 110.158 177.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 tp -77.64 140.53 39.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.844 0.858 . . . . 0.0 110.604 172.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.9 t -159.27 152.41 22.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.076 0.95 . . . . 0.0 111.425 -176.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 p -75.55 134.2 40.79 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.502 -1.374 . . . . 0.0 110.69 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 40.1 t -64.77 149.39 96.11 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.336 1.454 . . . . 0.0 113.625 -172.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -65.08 -15.29 49.69 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.994 2.463 . . . . 0.0 113.704 167.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -119.6 29.6 7.51 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.119 1.768 . . . . 0.0 114.082 -169.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -50.01 -44.24 51.08 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.49 1.116 . . . . 0.0 113.902 -175.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -93.53 -28.45 16.06 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.262 1.425 . . . . 0.0 113.6 175.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.36 -23.08 43.62 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -174.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 -60.77 135.48 57.79 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.531 1.132 . . . . 0.0 112.352 178.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -81.22 162.2 23.67 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.55 0.74 . . . . 0.0 112.054 172.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.84 137.63 40.59 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.209 0.604 . . . . 0.0 109.418 168.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -162.57 169.81 19.62 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.902 1.681 . . . . 0.0 110.664 174.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -148.25 96.3 2.6 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.929 0.892 . . . . 0.0 110.296 169.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 21.1 ttt85 -151.66 139.14 19.53 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.319 1.448 . . . . 0.0 111.632 -178.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.7 pt -107.02 -15.34 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.352 1.461 . . . . 0.0 114.495 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -160.53 159.62 30.91 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.073 1.349 . . . . 0.0 111.65 -172.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.3 p -68.22 -62.17 1.52 Allowed 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.658 -0.651 . . . . 0.0 110.614 169.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.7 t -162.03 144.58 11.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 126.518 1.927 . . . . 0.0 110.882 171.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.5 t -160.34 164.85 32.16 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.879 1.272 . . . . 0.0 112.0 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.2 ttt -144.71 129.96 18.67 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.753 1.621 . . . . 0.0 110.327 172.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -79.57 145.91 32.87 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -138.03 10.52 2.83 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.54 1.536 . . . . 0.0 113.314 175.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -70.47 129.07 38.27 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.18 1.392 . . . . 0.0 112.262 -178.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.1 tp -83.12 -31.91 26.98 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.461 1.104 . . . . 0.0 112.189 169.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -74.25 155.57 38.14 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.421 1.488 . . . . 0.0 112.829 175.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -153.56 169.2 23.8 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.598 1.559 . . . . 0.0 111.753 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.8 pp -143.31 170.23 16.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.474 1.509 . . . . 0.0 112.081 176.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -59.39 137.83 57.86 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.845 1.258 . . . . 0.0 112.549 -175.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.4 p-10 -141.86 -177.88 5.41 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.192 1.797 . . . . 0.0 112.081 -178.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 57.8 tp -144.34 142.96 30.73 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.758 1.623 . . . . 0.0 110.751 179.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -76.7 39.95 0.23 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.366 1.466 . . . . 0.0 113.795 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.3 p -84.91 -8.2 58.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.832 1.653 . . . . 0.0 114.798 -175.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 82.6 mt -66.11 151.47 46.84 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.581 1.153 . . . . 0.0 113.25 -176.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 23.9 t -65.95 137.94 57.49 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.459 0.704 . . . . 0.0 112.127 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? -78.92 152.13 31.31 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.119 1.368 . . . . 0.0 112.124 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.925 1.69 . . . . 0.0 112.875 175.414 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.619 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.6 mtt -70.33 155.0 94.12 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.041 0.936 . . . . 0.0 112.607 177.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.58 155.2 43.53 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.595 2.864 . . . . 0.0 113.837 174.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -65.38 156.11 65.07 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 123.404 2.736 . . . . 0.0 112.381 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.82 146.04 76.88 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.403 2.735 . . . . 0.0 112.571 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -79.22 1.23 25.44 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.409 1.262 . . . . 0.0 114.409 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -79.07 51.25 1.13 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.534 1.934 . . . . 0.0 112.75 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.8 mt -133.75 134.54 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.028 1.731 . . . . 0.0 109.028 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.03 131.09 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.896 1.278 . . . . 0.0 112.03 -174.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -75.5 140.85 43.05 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.068 0.947 . . . . 0.0 110.568 172.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -140.79 155.56 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.54 1.536 . . . . 0.0 111.241 -178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.53 143.94 38.51 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.24 1.016 . . . . 0.0 109.638 168.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.9 mt -131.27 123.86 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.617 0.767 . . . . 0.0 110.481 -170.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -81.77 143.23 31.95 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.336 1.454 . . . . 0.0 112.703 174.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -155.61 142.55 13.56 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.75 1.62 . . . . 0.0 110.508 169.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -63.75 142.92 85.04 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.723 2.282 . . . . 0.0 113.63 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.18 13.45 70.19 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.346 0.898 . . . . 0.0 115.346 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.27 156.58 46.41 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.262 1.425 . . . . 0.0 112.587 -177.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -70.19 153.37 95.31 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.652 0.781 . . . . 0.0 111.267 169.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.11 128.13 25.45 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.663 2.242 . . . . 0.0 112.502 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -83.33 123.36 29.56 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.814 0.846 . . . . 0.0 110.696 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 83.3 mt -85.79 135.59 33.67 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.529 0.732 . . . . 0.0 109.549 168.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -156.49 174.83 14.86 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.57 1.148 . . . . 0.0 111.486 174.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -120.2 118.34 30.24 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.245 1.018 . . . . 0.0 111.605 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.6 mt -83.69 111.28 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.241 1.417 . . . . 0.0 108.929 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -85.37 118.32 24.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.423 1.089 . . . . 0.0 109.629 169.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -68.56 -12.52 61.4 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -84.18 -23.65 30.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.515 1.126 . . . . 0.0 113.43 171.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -76.13 147.26 79.75 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 123.946 0.898 . . . . 0.0 111.929 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.84 144.14 63.83 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.974 2.45 . . . . 0.0 111.1 171.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.42 -32.08 72.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.994 -0.527 . . . . 0.0 112.173 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.6 m -58.4 -42.39 87.03 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.07 0.85 . . . . 0.0 112.555 174.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -41.61 71.93 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.897 -0.502 . . . . 0.0 111.958 175.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.09 -47.96 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.492 -0.755 . . . . 0.0 110.678 176.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.2 mt -59.82 -40.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.491 1.116 . . . . 0.0 110.671 177.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -58.99 -42.84 91.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.149 0.886 . . . . 0.0 112.514 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.59 -32.27 72.89 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.474 0.71 . . . . 0.0 112.469 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -68.57 -51.94 41.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 O-C-N 121.509 -0.744 . . . . 0.0 110.942 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 95.3 m -58.98 -44.1 91.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.785 0.834 . . . . 0.0 112.092 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -60.77 -29.38 69.39 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.218 1.007 . . . . 0.0 112.93 176.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.5 -23.52 66.87 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.241 0.924 . . . . 0.0 114.411 174.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -112.96 14.24 19.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.863 1.665 . . . . 0.0 113.261 171.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.3 m 55.33 25.96 8.13 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.914 1.686 . . . . 0.0 114.438 -175.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.82 119.49 17.12 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.813 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.47 165.03 25.88 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.388 1.075 . . . . 0.0 112.193 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.3 m120 55.23 53.87 9.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.326 1.45 . . . . 0.0 113.417 173.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -57.8 -17.57 16.67 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.244 1.018 . . . . 0.0 113.654 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -56.42 -20.46 19.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.835 1.654 . . . . 0.0 113.859 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -84.85 -15.92 43.06 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.639 1.576 . . . . 0.0 112.497 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -99.2 159.9 14.65 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.55 151.03 37.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.849 2.459 . . . . 0.0 109.81 171.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.3 mt -84.21 155.44 22.51 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 167.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -149.81 150.03 31.39 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.673 1.189 . . . . 0.0 110.044 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 -67.43 150.8 48.44 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.582 -0.698 . . . . 0.0 112.671 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.48 -6.19 2.92 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.722 1.209 . . . . 0.0 114.176 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -73.32 71.53 1.25 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.036 1.335 . . . . 0.0 111.755 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.2 m 62.63 -46.19 0.19 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 128.906 2.882 . . . . 0.0 115.558 -173.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.3 m -72.11 150.33 43.97 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.067 1.347 . . . . 0.0 111.604 169.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -130.08 37.11 3.94 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.539 1.535 . . . . 0.0 112.475 -178.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -65.69 134.41 53.16 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.169 -0.957 . . . . 0.0 110.911 171.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -67.86 144.29 55.36 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.965 -0.46 . . . . 0.0 110.354 169.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.9 mm -79.7 138.12 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.546 0.738 . . . . 0.0 110.715 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.4 p -146.3 173.37 12.31 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.492 2.317 . . . . 0.0 109.223 -175.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -58.47 -21.27 50.93 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 174.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -90.12 -45.65 8.99 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.775 1.23 . . . . 0.0 112.599 170.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -78.11 -21.16 50.82 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.994 0.918 . . . . 0.0 113.286 -171.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -57.81 -26.17 61.6 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.205 1.002 . . . . 0.0 113.676 173.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -74.0 -17.28 61.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.695 1.198 . . . . 0.0 113.071 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -79.4 -14.42 58.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.188 0.995 . . . . 0.0 112.831 173.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.3 mt -71.33 132.01 33.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.397 1.079 . . . . 0.0 109.641 174.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -122.88 165.24 16.99 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.903 1.681 . . . . 0.0 111.568 173.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -60.12 121.8 12.81 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 121.721 -0.612 . . . . 0.0 110.944 178.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.66 63.92 Favored Glycine 0 CA--C 1.541 1.663 0 C-N-CA 125.302 1.429 . . . . 0.0 115.648 -174.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.5 m -63.77 134.14 54.76 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.64 1.72 . . . . 0.0 111.191 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.6 mt -91.02 121.83 41.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 121.93 0.871 . . . . 0.0 109.3 169.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.2 mt -111.85 177.6 4.59 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.337 2.255 . . . . 0.0 110.434 176.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -139.24 145.89 39.78 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.144 1.778 . . . . 0.0 110.251 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.7 tp -85.11 140.16 31.17 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.718 0.807 . . . . 0.0 109.759 170.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -155.3 150.84 27.31 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.877 0.871 . . . . 0.0 111.061 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.3 p -76.13 134.33 40.0 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.796 -1.19 . . . . 0.0 110.435 169.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.4 t -64.04 137.56 97.14 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 123.676 0.79 . . . . 0.0 112.122 -175.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -69.78 -10.46 28.59 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 123.689 2.926 . . . . 0.0 113.885 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -111.32 3.82 18.58 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.733 1.613 . . . . 0.0 114.078 -177.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -73.67 -33.27 64.38 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -168.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -75.66 -39.6 57.39 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.128 0.971 . . . . 0.0 112.248 176.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -157.61 138.57 13.31 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.995 2.118 . . . . 0.0 109.018 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -66.14 125.08 24.38 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.638 0.775 . . . . 0.0 112.245 -170.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.35 -19.23 60.52 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.314 1.045 . . . . 0.0 112.953 177.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 29.9 tp -147.81 141.95 26.07 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.304 1.842 . . . . 0.0 110.839 -176.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -133.16 -0.02 3.37 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.782 1.233 . . . . 0.0 114.299 -175.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -152.26 151.29 30.75 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.383 1.873 . . . . 0.0 109.786 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 22.0 tpt85 -74.19 74.15 1.78 Allowed 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.944 0.878 . . . . 0.0 112.292 178.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 77.6 mt -65.93 154.01 8.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 124.963 1.305 . . . . 0.0 107.756 167.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -55.59 -31.31 62.11 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -173.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.4 t -139.77 151.19 45.59 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.796 1.638 . . . . 0.0 110.789 169.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.8 m -69.29 -17.0 63.69 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -174.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 79.4 p -155.46 158.92 39.33 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.725 1.61 . . . . 0.0 111.661 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 94.2 mtp -72.63 -24.89 61.12 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -139.95 149.91 43.87 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.547 1.939 . . . . 0.0 111.019 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.69 -9.95 59.59 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -178.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -67.52 139.8 56.98 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.876 1.27 . . . . 0.0 112.549 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.4 mt -78.55 159.8 27.96 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.515 1.126 . . . . 0.0 111.479 169.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -140.67 163.6 32.45 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.281 1.432 . . . . 0.0 112.312 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -76.53 56.89 1.16 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.24 1.416 . . . . 0.0 112.776 176.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -63.5 -13.22 38.71 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.432 1.493 . . . . 0.0 114.779 -171.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -57.34 -27.77 62.54 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.689 1.196 . . . . 0.0 113.602 170.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -76.29 -30.34 57.74 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.182 0.993 . . . . 0.0 112.918 174.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.1 tp -87.21 -28.56 22.31 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.587 1.555 . . . . 0.0 113.052 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.02 143.05 49.56 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.157 1.383 . . . . 0.0 113.728 -174.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.3 m -73.64 -13.97 61.09 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.296 1.438 . . . . 0.0 114.607 -174.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 35.8 mt 60.18 9.3 1.83 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 127.294 2.238 . . . . 0.0 115.27 -174.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 23.9 t -161.13 156.87 25.03 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 127.521 2.328 . . . . 0.0 109.585 176.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -83.84 134.93 34.68 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.775 0.83 . . . . 0.0 112.584 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 . . . . . 0 C--O 1.254 1.316 0 C-N-CA 124.719 1.208 . . . . 0.0 113.203 169.899 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.699 0 N-CA-C 112.059 -0.416 . . . . 0.0 112.059 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt -69.79 156.2 92.15 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.006 0.922 . . . . 0.0 112.717 177.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -60.24 158.36 31.06 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.401 2.734 . . . . 0.0 113.967 175.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -60.03 154.32 51.9 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.451 2.767 . . . . 0.0 113.892 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -59.38 145.18 98.67 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.569 2.846 . . . . 0.0 113.811 176.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.63 158.43 33.66 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.227 1.011 . . . . 0.0 112.879 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 46.7 p-10 -83.78 10.1 10.32 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.547 1.539 . . . . 0.0 113.868 172.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.3 mt -137.51 135.94 46.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 126.37 1.868 . . . . 0.0 108.745 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.4 m -133.36 133.28 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.929 1.292 . . . . 0.0 112.091 -176.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -78.85 140.32 38.19 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.931 0.892 . . . . 0.0 111.376 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.51 157.64 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 125.82 1.648 . . . . 0.0 111.638 -177.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.16 28.49 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.622 1.169 . . . . 0.0 110.201 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.3 mt -106.22 127.29 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 124.352 1.061 . . . . 0.0 110.442 -171.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 67.5 mt-10 -89.24 149.53 23.05 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.038 1.335 . . . . 0.0 112.994 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -151.63 142.86 15.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 126.093 1.757 . . . . 0.0 110.053 170.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -60.91 137.19 70.77 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.545 2.163 . . . . 0.0 113.54 -175.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.67 12.49 74.1 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.454 0.941 . . . . 0.0 115.454 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.9 153.4 51.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.201 1.4 . . . . 0.0 112.765 -178.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -69.64 151.41 96.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.653 0.781 . . . . 0.0 111.33 170.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.1 130.32 33.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 113.321 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.16 111.79 18.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.202 1.401 . . . . 0.0 110.234 175.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.8 127.87 33.11 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.404 0.682 . . . . 0.0 109.575 169.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -155.01 177.86 10.84 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.134 0.974 . . . . 0.0 111.602 173.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -113.34 135.07 54.26 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.933 . . . . 0.0 112.202 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.2 mt -95.57 110.01 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.721 1.608 . . . . 0.0 108.245 171.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -87.9 114.93 24.98 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.185 1.394 . . . . 0.0 110.074 175.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -70.9 -10.28 59.34 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -85.38 -21.93 28.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.372 1.069 . . . . 0.0 113.225 170.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -81.01 148.73 65.05 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 124.371 1.069 . . . . 0.0 112.781 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.05 146.39 76.87 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.94 2.427 . . . . 0.0 110.931 169.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -61.67 -29.85 70.35 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.556 177.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -58.7 -46.06 88.15 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.209 0.913 . . . . 0.0 112.232 172.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.14 -40.68 98.27 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.605 -0.684 . . . . 0.0 112.09 176.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 90.3 mt -66.42 -48.97 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.473 0.709 . . . . 0.0 110.568 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.78 -36.88 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.389 1.076 . . . . 0.0 110.94 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.69 -40.5 92.46 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.791 0.836 . . . . 0.0 112.304 171.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -70.74 -25.81 63.09 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.355 1.062 . . . . 0.0 113.589 173.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.83 -61.93 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.865 1.211 . . . . 0.0 110.902 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.9 p -63.51 -33.79 76.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.777 0.831 . . . . 0.0 112.76 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.02 -28.61 69.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.905 0.882 . . . . 0.0 113.017 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.94 -23.24 69.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.242 0.925 . . . . 0.0 114.205 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -115.79 12.99 16.04 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.864 1.666 . . . . 0.0 113.172 173.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m 55.78 27.04 10.23 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.0 1.72 . . . . 0.0 114.589 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.53 130.8 37.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.212 1.405 . . . . 0.0 110.738 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.65 163.84 21.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.598 1.159 . . . . 0.0 113.789 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 52.61 68.81 0.77 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.686 1.994 . . . . 0.0 113.65 169.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -63.58 -17.77 63.19 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 -171.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -54.65 -32.95 59.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.505 1.522 . . . . 0.0 112.989 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -73.09 -21.29 60.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.388 1.075 . . . . 0.0 112.692 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -94.53 158.3 15.6 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.587 1.184 . . . . 0.0 114.159 -169.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.28 150.04 34.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.679 2.391 . . . . 0.0 109.725 173.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.3 mt -81.86 158.58 23.97 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 166.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -148.93 148.12 29.44 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.573 1.149 . . . . 0.0 110.243 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -67.24 130.75 44.09 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.933 -0.48 . . . . 0.0 111.69 172.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.26 2.96 54.99 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.634 1.174 . . . . 0.0 113.849 178.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -70.99 -171.34 0.54 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.184 1.794 . . . . 0.0 112.102 175.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.5 m -58.9 -26.95 64.78 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.414 -1.428 . . . . 0.0 112.515 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.5 t -93.39 136.26 33.83 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.038 1.335 . . . . 0.0 110.342 168.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -126.14 39.84 3.86 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.373 1.469 . . . . 0.0 112.419 -172.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -61.19 136.76 58.17 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.524 -0.735 . . . . 0.0 111.519 169.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -68.68 145.87 53.49 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 167.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.1 mm -76.07 136.54 24.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.764 0.792 . . . . 0.0 110.108 174.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.4 p -142.86 171.42 14.08 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.251 2.22 . . . . 0.0 108.768 -175.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -59.95 -18.15 43.25 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.361 -0.837 . . . . 0.0 113.131 176.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -89.59 -54.07 4.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.907 1.683 . . . . 0.0 111.391 168.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -69.6 -23.59 63.55 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.12 0.968 . . . . 0.0 113.126 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -55.46 -27.95 51.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -73.21 -18.06 61.29 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.334 1.054 . . . . 0.0 112.972 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -85.44 -13.97 47.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.668 1.187 . . . . 0.0 112.648 176.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.8 mt -66.54 137.85 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.657 1.183 . . . . 0.0 109.648 172.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -137.43 165.76 25.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.406 1.882 . . . . 0.0 111.828 -179.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.39 124.54 18.44 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.852 -0.53 . . . . 0.0 112.015 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.61 10.24 73.6 Favored Glycine 0 CA--C 1.539 1.532 0 C-N-CA 124.843 1.211 . . . . 0.0 115.514 -175.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 91.9 m -63.57 128.7 37.01 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.761 1.781 . . . . 0.0 110.792 175.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -86.82 123.23 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.6 mt -119.07 174.09 6.52 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.18 1.792 . . . . 0.0 110.957 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -139.2 135.5 34.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.544 1.938 . . . . 0.0 109.996 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.3 tp -79.47 135.9 36.78 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.071 0.548 . . . . 0.0 109.664 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.6 t -155.65 154.48 31.66 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.158 0.983 . . . . 0.0 110.216 -175.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.7 p -71.96 134.48 45.99 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.411 -1.431 . . . . 0.0 110.386 169.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t -58.55 141.51 83.89 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.298 1.039 . . . . 0.0 110.614 174.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.53 -15.56 50.11 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.639 2.226 . . . . 0.0 112.861 176.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -96.92 -10.16 26.96 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.237 1.415 . . . . 0.0 114.254 170.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 53.99 27.92 8.02 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.031 1.732 . . . . 0.0 113.936 -168.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -146.89 172.81 13.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 128.626 2.77 . . . . 0.0 108.727 173.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.33 128.58 34.83 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.514 -0.741 . . . . 0.0 111.777 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -81.43 53.8 2.17 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.344 1.458 . . . . 0.0 113.152 -169.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -68.14 136.99 54.55 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.572 1.549 . . . . 0.0 113.557 -172.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mp -74.86 132.72 41.71 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.489 1.116 . . . . 0.0 110.506 170.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -80.4 -25.77 38.87 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -158.81 151.29 21.69 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.721 1.608 . . . . 0.0 111.206 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 62.4 ttt-85 -74.9 116.24 15.41 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.277 1.031 . . . . 0.0 110.284 174.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.9 mt -71.37 -43.85 72.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.66 0.784 . . . . 0.0 111.439 -174.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.73 127.42 32.77 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.018 0.927 . . . . 0.0 110.756 175.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 78.7 p -75.79 -28.96 58.57 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -174.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 34.5 t -155.79 152.06 28.0 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.514 1.526 . . . . 0.0 111.17 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.4 t -74.55 65.84 1.33 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.562 1.545 . . . . 0.0 112.903 -176.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 69.6 mtm -69.66 162.02 28.52 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.183 1.793 . . . . 0.0 112.599 176.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -60.4 127.83 33.71 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.27 1.028 . . . . 0.0 111.692 177.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.49 -13.78 62.25 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -122.17 143.91 49.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.254 1.422 . . . . 0.0 112.776 -177.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.6 tp -84.42 131.73 34.64 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.412 1.485 . . . . 0.0 110.156 169.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -76.7 -34.38 58.17 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -177.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -164.32 155.65 15.73 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.94 1.696 . . . . 0.0 111.215 -179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.92 133.44 50.9 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.678 -0.638 . . . . 0.0 110.42 170.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -74.3 134.88 42.58 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.884 0.874 . . . . 0.0 111.881 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -79.45 144.39 34.08 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.932 0.893 . . . . 0.0 111.877 171.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 96.4 mt -140.08 134.18 30.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.618 1.567 . . . . 0.0 110.609 177.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -158.9 156.23 29.17 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.588 1.555 . . . . 0.0 111.537 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.4 t -72.92 148.66 44.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.323 0.649 . . . . 0.0 112.092 171.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.3 mt -79.51 -9.48 59.62 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.573 1.149 . . . . 0.0 113.53 174.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 60.4 m -136.28 153.29 51.22 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.471 1.508 . . . . 0.0 112.759 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -68.52 -33.97 75.06 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.548 1.139 . . . . 0.0 112.982 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.4 t0 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.542 1.937 . . . . 0.0 111.822 -179.01 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.5 mtt -140.42 149.8 58.74 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.626 1.57 . . . . 0.0 111.574 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.18 159.22 54.7 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 123.415 2.744 . . . . 0.0 113.01 177.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.46 162.09 38.16 Favored 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 123.519 2.813 . . . . 0.0 112.309 172.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -76.24 53.23 3.79 Favored 'Trans proline' 0 CA--C 1.551 1.352 0 C-N-CA 124.957 3.771 . . . . 0.0 112.904 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 60.49 166.74 0.08 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 128.014 2.526 . . . . 0.0 115.05 -171.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -80.59 49.58 1.19 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.306 1.442 . . . . 0.0 112.143 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt -125.65 135.43 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.141 1.377 . . . . 0.0 110.557 -170.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.0 m -129.55 126.41 63.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.585 1.554 . . . . 0.0 111.597 -178.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -74.13 140.23 45.08 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.981 0.912 . . . . 0.0 110.84 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 m -137.91 154.45 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.13 1.372 . . . . 0.0 111.83 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.08 38.8 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.946 1.298 . . . . 0.0 109.615 171.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.4 mt -110.18 123.95 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.725 0.81 . . . . 0.0 110.38 -170.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -88.57 153.32 21.22 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.886 1.274 . . . . 0.0 113.238 176.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -153.76 142.48 14.47 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 126.134 1.773 . . . . 0.0 109.658 169.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -60.12 133.94 53.09 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.51 2.14 . . . . 0.0 113.295 -175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.93 11.04 78.37 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 115.409 0.924 . . . . 0.0 115.409 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.49 151.56 51.46 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.975 1.387 . . . . 0.0 112.805 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -70.34 150.27 95.83 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.703 0.801 . . . . 0.0 111.371 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -61.09 130.18 31.53 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.421 2.08 . . . . 0.0 113.383 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -83.55 111.15 18.82 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.121 1.368 . . . . 0.0 110.124 175.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.43 132.47 39.68 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.674 0.79 . . . . 0.0 110.227 169.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -157.24 178.08 10.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.411 1.085 . . . . 0.0 111.688 177.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -122.21 131.25 53.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.492 1.117 . . . . 0.0 112.174 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 mt -100.19 109.79 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.636 1.575 . . . . 0.0 108.864 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -81.14 117.85 22.04 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 168.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -65.05 -13.89 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -86.22 -22.21 27.03 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.758 1.223 . . . . 0.0 114.087 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -86.13 149.56 50.34 Favored Pre-proline 0 N--CA 1.483 1.181 0 CA-C-N 119.778 1.172 . . . . 0.0 111.691 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.47 144.01 39.74 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.067 2.512 . . . . 0.0 112.337 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.4 mt -61.77 -31.73 71.95 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.445 0.698 . . . . 0.0 112.438 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.4 m -59.38 -42.4 91.61 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.168 0.894 . . . . 0.0 112.301 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.5 81.83 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.145 0.578 . . . . 0.0 111.902 175.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.81 -50.76 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.492 0.717 . . . . 0.0 110.581 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.5 mt -61.51 -38.54 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.073 -1.017 . . . . 0.0 110.865 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.3 -38.95 88.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.721 0.809 . . . . 0.0 112.552 171.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -72.25 -27.81 62.74 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.396 1.079 . . . . 0.0 113.488 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.41 -61.11 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.259 -0.9 . . . . 0.0 111.098 172.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 30.2 p -61.55 -33.45 73.86 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.582 0.753 . . . . 0.0 112.849 -171.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -60.27 -30.85 69.72 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.325 1.05 . . . . 0.0 112.893 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -23.13 67.93 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.378 0.989 . . . . 0.0 114.064 175.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -114.9 12.36 16.85 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.955 1.702 . . . . 0.0 113.307 173.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.3 p 55.93 22.67 5.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 127.284 2.233 . . . . 0.0 115.4 -176.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.62 125.99 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.083 1.353 . . . . 0.0 110.677 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.0 166.2 22.6 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.636 1.174 . . . . 0.0 113.4 -177.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 m120 54.06 63.13 2.29 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.984 1.714 . . . . 0.0 113.397 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -59.85 -25.44 65.03 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.208 -0.933 . . . . 0.0 113.482 -174.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -64.73 -15.84 62.08 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.852 1.261 . . . . 0.0 113.89 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -77.81 -20.87 52.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.161 -0.962 . . . . 0.0 112.407 168.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -94.38 160.81 14.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.903 1.281 . . . . 0.0 114.145 -169.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.43 157.38 43.76 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.829 2.451 . . . . 0.0 109.917 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 40.3 mt -87.41 151.69 22.86 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 167.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -139.22 144.4 38.46 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.813 1.245 . . . . 0.0 109.959 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -65.0 141.42 58.78 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.061 0.544 . . . . 0.0 112.377 176.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -129.26 -28.99 2.28 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.893 1.277 . . . . 0.0 112.776 174.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -70.56 -47.76 58.7 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.466 -0.771 . . . . 0.0 110.821 168.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 t -84.83 -177.07 6.49 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.937 1.295 . . . . 0.0 111.408 169.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.4 t -60.31 162.11 6.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.868 0.867 . . . . 0.0 111.718 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.99 38.61 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 127.341 2.257 . . . . 0.0 116.969 -169.015 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -68.35 135.48 51.88 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.136 -1.603 . . . . 0.0 111.697 173.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -70.8 144.74 50.72 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.678 -0.639 . . . . 0.0 110.645 169.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -77.92 134.06 29.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.507 0.723 . . . . 0.0 109.673 173.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -139.31 169.55 17.56 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.97 1.708 . . . . 0.0 109.776 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -58.41 -21.29 50.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.099 0.96 . . . . 0.0 113.385 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -93.59 -47.48 6.8 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.295 1.438 . . . . 0.0 112.667 169.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -76.64 -17.25 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -54.29 -25.45 23.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.967 1.307 . . . . 0.0 114.231 171.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -67.54 -15.87 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.072 0.949 . . . . 0.0 113.512 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -79.17 -11.63 59.97 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.077 0.951 . . . . 0.0 113.426 171.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.0 mt -71.53 134.47 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 O-C-N 121.272 -0.893 . . . . 0.0 109.771 173.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -121.5 166.36 14.27 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.843 2.057 . . . . 0.0 111.629 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -57.57 124.03 17.64 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 121.855 -0.528 . . . . 0.0 110.738 173.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.51 11.59 68.54 Favored Glycine 0 CA--C 1.539 1.549 0 C-N-CA 125.11 1.338 . . . . 0.0 115.465 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.4 m -65.12 131.62 47.02 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 119.455 1.628 . . . . 0.0 111.599 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.3 mt -85.31 124.4 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 169.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.6 mt -119.46 174.65 6.25 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.845 2.058 . . . . 0.0 110.263 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -141.92 137.46 31.32 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.938 1.695 . . . . 0.0 110.181 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -77.09 139.84 40.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.956 0.902 . . . . 0.0 110.595 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.2 t -157.35 151.38 24.6 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.976 0.911 . . . . 0.0 111.242 -176.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.0 p -69.86 126.71 30.51 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.565 -1.335 . . . . 0.0 110.321 169.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 45.0 t -65.0 140.84 98.23 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 125.121 1.369 . . . . 0.0 111.875 -177.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.17 -29.57 56.91 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.002 2.468 . . . . 0.0 113.313 172.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.96 -19.9 47.45 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -72.09 -10.13 59.36 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.391 0.996 . . . . 0.0 113.574 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -137.49 -61.15 0.65 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.821 1.248 . . . . 0.0 112.97 178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -162.65 137.68 6.82 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.407 1.483 . . . . 0.0 111.714 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -146.13 72.77 1.31 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.679 1.192 . . . . 0.0 110.799 178.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -71.43 150.88 44.52 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.427 1.091 . . . . 0.0 112.894 -178.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.2 tp -67.82 150.5 48.53 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.519 1.128 . . . . 0.0 111.509 171.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -138.98 157.94 45.1 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.117 1.367 . . . . 0.0 112.304 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -80.98 65.53 6.16 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.275 1.43 . . . . 0.0 113.032 -171.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -0.96 1.87 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.6 1.56 . . . . 0.0 114.821 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 94.3 mt -54.58 -36.29 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.999 1.32 . . . . 0.0 111.269 175.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -88.06 133.77 33.9 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.801 1.24 . . . . 0.0 112.795 173.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.0 p -163.19 152.0 14.42 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.759 1.624 . . . . 0.0 111.148 169.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.9 t -71.46 149.82 45.51 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.807 0.843 . . . . 0.0 112.983 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 80.0 p -77.22 -7.66 56.28 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.324 1.45 . . . . 0.0 113.675 171.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 76.9 mtm -134.35 165.08 25.97 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.953 1.701 . . . . 0.0 112.307 -176.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -149.67 164.73 34.4 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.151 1.38 . . . . 0.0 111.512 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.36 159.37 34.13 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.656 1.182 . . . . 0.0 112.711 174.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 32.6 tttp 59.86 22.24 11.2 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.386 1.875 . . . . 0.0 115.283 173.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.3 mt -77.52 -24.11 50.05 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.221 1.009 . . . . 0.0 113.129 174.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -74.78 153.21 38.88 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.506 1.523 . . . . 0.0 113.085 176.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -153.23 155.4 36.53 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.935 1.294 . . . . 0.0 112.272 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.1 pp -72.6 165.19 25.19 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.539 1.135 . . . . 0.0 112.539 172.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -144.53 152.75 41.02 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.23 1.412 . . . . 0.0 112.665 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 39.2 p-10 -88.65 174.39 8.07 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.649 1.58 . . . . 0.0 112.315 171.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 94.9 mt -126.35 151.38 47.67 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.882 1.673 . . . . 0.0 111.132 175.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -152.67 171.35 18.32 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.216 1.406 . . . . 0.0 112.315 -175.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 40.3 t -145.65 148.71 33.37 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.419 1.488 . . . . 0.0 111.728 176.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 84.2 mt -75.91 -11.42 59.96 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.68 1.192 . . . . 0.0 113.213 173.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.7 t 54.47 47.84 21.89 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.354 1.462 . . . . 0.0 112.197 -173.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -62.05 134.82 57.11 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.698 1.599 . . . . 0.0 112.15 -173.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 . . . . . 0 C--O 1.253 1.249 0 C-N-CA 126.632 1.973 . . . . 0.0 113.242 174.897 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.0 mmm 63.26 159.28 0.12 Allowed Pre-proline 0 N--CA 1.482 1.149 0 C-N-CA 127.342 2.257 . . . . 0.0 114.838 -173.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -61.59 141.06 90.07 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 122.951 2.434 . . . . 0.0 113.335 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.51 150.33 87.91 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.215 2.61 . . . . 0.0 113.369 175.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.54 3.25 5.52 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.938 3.092 . . . . 0.0 115.043 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.29 4.03 21.96 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.273 1.829 . . . . 0.0 113.873 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.0 p-10 -75.63 7.16 3.97 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.698 1.599 . . . . 0.0 115.167 -178.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.6 mt -137.29 134.95 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 125.97 1.708 . . . . 0.0 108.89 170.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -135.48 132.82 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.056 1.342 . . . . 0.0 112.136 -177.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -71.34 141.14 50.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.98 0.912 . . . . 0.0 111.396 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.3 m -141.81 155.14 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.942 1.297 . . . . 0.0 111.927 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.16 39.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.898 1.279 . . . . 0.0 109.792 171.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -109.18 125.23 66.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.922 0.889 . . . . 0.0 110.48 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -91.89 151.05 20.73 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.879 1.272 . . . . 0.0 113.381 177.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -151.35 143.38 16.08 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.069 1.748 . . . . 0.0 109.937 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -59.67 135.16 62.25 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.544 2.162 . . . . 0.0 113.505 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.58 11.32 76.92 Favored Glycine 0 CA--C 1.539 1.571 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -132.81 152.37 51.82 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.873 1.336 . . . . 0.0 112.866 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -70.44 152.18 95.51 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 123.689 0.796 . . . . 0.0 111.515 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.34 129.72 29.37 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.5 2.133 . . . . 0.0 113.265 -178.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -82.56 109.31 16.65 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.205 1.402 . . . . 0.0 110.05 174.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.8 131.9 40.06 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.723 0.809 . . . . 0.0 110.205 170.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -156.48 178.19 10.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.198 0.999 . . . . 0.0 112.067 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -118.58 122.45 42.65 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.701 1.2 . . . . 0.0 111.474 174.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.3 mt -84.78 108.46 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 124.425 1.09 . . . . 0.0 108.257 169.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -81.77 114.86 20.7 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.094 0.957 . . . . 0.0 108.825 169.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.01 -12.07 60.1 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -175.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -88.44 -23.06 23.39 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.761 1.224 . . . . 0.0 113.422 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -78.94 143.07 61.1 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.182 0.993 . . . . 0.0 111.295 174.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.52 144.41 66.75 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.089 2.526 . . . . 0.0 111.411 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -61.69 -30.06 70.5 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 118.78 -0.629 . . . . 0.0 112.615 178.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.3 p -59.98 -44.68 94.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.644 1.111 . . . . 0.0 112.402 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.72 -40.02 88.25 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.263 0.625 . . . . 0.0 112.055 174.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.7 -46.89 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.585 0.754 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.05 -37.02 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.581 1.153 . . . . 0.0 111.077 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -61.49 -38.62 87.97 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.743 0.701 . . . . 0.0 112.32 171.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -72.03 -25.13 61.69 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.329 1.052 . . . . 0.0 113.337 174.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 46.4 t -72.07 -57.6 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.277 0.944 . . . . 0.0 110.976 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.7 p -62.18 -33.76 75.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.865 0.866 . . . . 0.0 112.562 -169.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.17 -28.94 69.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.557 1.143 . . . . 0.0 113.029 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.11 -23.0 69.41 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.303 0.954 . . . . 0.0 114.088 175.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -117.73 10.28 13.28 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.052 1.741 . . . . 0.0 113.193 174.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.0 t 54.69 33.6 19.77 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.274 1.83 . . . . 0.0 113.865 -176.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -80.69 125.21 29.75 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.708 1.203 . . . . 0.0 110.489 179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.26 165.82 22.81 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.77 1.228 . . . . 0.0 113.245 -178.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 54.03 59.83 4.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.922 1.689 . . . . 0.0 113.569 172.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -60.24 -19.97 56.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -176.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -56.27 -29.27 60.9 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.237 1.415 . . . . 0.0 112.913 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -78.9 -19.75 51.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.015 0.926 . . . . 0.0 112.726 178.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -91.16 158.32 16.69 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -169.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.73 150.67 35.82 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.354 2.262 . . . . 0.0 110.086 172.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -82.54 153.45 25.53 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 167.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -145.4 150.36 36.4 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.826 1.25 . . . . 0.0 109.698 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -63.42 138.86 58.67 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.487 -0.758 . . . . 0.0 111.146 173.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.96 -8.7 57.86 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 -174.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -67.31 176.55 2.21 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.918 1.287 . . . . 0.0 112.983 175.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 17.5 m -63.72 -10.77 21.27 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 99.4 p -70.67 165.55 22.67 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.355 1.462 . . . . 0.0 112.852 172.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -102.09 12.44 36.8 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.586 1.554 . . . . 0.0 113.712 178.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 12.4 m-30 -63.57 100.08 0.25 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.382 1.073 . . . . 0.0 113.183 -169.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -70.95 143.37 50.91 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.762 0.825 . . . . 0.0 110.964 170.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.4 mm -82.19 129.6 37.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 124.375 1.07 . . . . 0.0 109.283 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.7 p -142.53 167.19 22.68 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.619 1.568 . . . . 0.0 109.965 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -63.1 -10.01 12.91 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 120.979 -1.076 . . . . 0.0 113.451 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -105.68 -4.88 20.49 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.517 1.927 . . . . 0.0 114.406 173.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -130.22 -14.48 3.83 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -174.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.55 -18.47 59.38 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 178.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.47 -22.58 66.97 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.869 1.268 . . . . 0.0 112.959 174.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -75.15 -14.17 60.53 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.987 0.915 . . . . 0.0 113.184 177.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -73.77 132.64 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.472 1.109 . . . . 0.0 110.172 177.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -118.13 167.31 11.6 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.144 1.778 . . . . 0.0 111.886 170.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -59.41 127.27 31.23 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.633 -0.667 . . . . 0.0 110.979 172.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.77 10.35 69.96 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.041 1.305 . . . . 0.0 115.305 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.5 m -65.98 131.39 46.13 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.563 1.682 . . . . 0.0 111.084 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mt -89.74 125.02 42.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 172.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 89.5 mt -120.37 173.45 7.13 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.679 1.992 . . . . 0.0 110.578 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -139.83 146.88 39.93 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.793 1.637 . . . . 0.0 110.594 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.7 tp -85.22 138.98 32.0 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.219 1.008 . . . . 0.0 110.173 173.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.7 t -157.65 156.37 31.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.157 0.983 . . . . 0.0 110.871 -176.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.4 p -71.02 139.26 50.43 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.415 -1.428 . . . . 0.0 110.568 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.9 p -63.05 158.49 54.36 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 126.011 1.724 . . . . 0.0 113.635 -171.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -67.49 -26.01 40.89 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.078 1.852 . . . . 0.0 112.11 169.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.22 -31.26 71.5 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.72 1.208 . . . . 0.0 113.74 -177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.42 -10.82 59.69 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 177.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -90.33 143.31 26.88 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.413 1.085 . . . . 0.0 112.619 -176.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . 57.28 179.44 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.957 2.103 . . . . 0.0 115.762 175.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -70.3 142.28 52.26 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.838 1.255 . . . . 0.0 111.604 175.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -83.01 -14.05 54.72 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 52.6 tp -69.44 139.21 54.0 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.973 1.309 . . . . 0.0 112.359 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 35.0 p80 -151.81 167.55 27.91 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.5 1.52 . . . . 0.0 111.799 176.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -151.03 164.87 35.43 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.512 1.525 . . . . 0.0 111.717 176.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -140.9 145.54 36.25 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.726 1.611 . . . . 0.0 111.811 -177.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 39.8 pt -69.07 158.78 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.922 1.289 . . . . 0.0 112.901 178.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -143.38 27.48 1.55 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.462 1.505 . . . . 0.0 112.584 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 79.4 p -69.71 -17.36 63.46 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -171.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 33.8 t -153.12 143.05 22.17 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.76 1.224 . . . . 0.0 112.283 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.2 t -160.48 155.19 23.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.293 1.837 . . . . 0.0 110.661 175.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 91.0 mtp -75.62 133.77 40.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.841 0.856 . . . . 0.0 111.839 177.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -72.96 -28.5 62.46 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -153.99 151.99 30.03 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.94 1.696 . . . . 0.0 111.051 176.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -138.9 107.32 5.82 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.596 1.558 . . . . 0.0 110.681 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.9 mt -84.02 -32.71 24.76 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.354 1.062 . . . . 0.0 113.464 -176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 51.74 34.88 13.87 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.514 1.926 . . . . 0.0 114.615 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.36 139.09 58.53 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.829 1.252 . . . . 0.0 113.367 -175.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.7 mt -82.71 162.9 21.63 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.058 1.343 . . . . 0.0 112.128 174.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -146.31 150.08 35.07 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.3 1.44 . . . . 0.0 112.547 175.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -93.68 151.34 19.72 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.846 1.259 . . . . 0.0 111.763 172.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 96.5 mt -138.44 143.59 39.75 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.713 1.605 . . . . 0.0 110.889 176.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.85 153.17 37.0 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.183 0.993 . . . . 0.0 112.962 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.0 p -155.71 149.99 25.75 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.202 1.401 . . . . 0.0 111.824 175.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -156.65 161.6 39.88 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.721 1.608 . . . . 0.0 111.98 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 22.6 t -154.58 155.13 34.19 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.146 1.378 . . . . 0.0 111.539 174.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -75.65 164.27 26.47 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.174 1.39 . . . . 0.0 112.396 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 . . . . . 0 C--O 1.254 1.32 0 C-N-CA 127.342 2.257 . . . . 0.0 114.002 175.379 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.669 0 N-CA-C 112.076 -0.41 . . . . 0.0 112.076 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.6 tpt -149.81 126.27 5.24 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 125.283 1.433 . . . . 0.0 110.52 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -71.74 160.09 49.01 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 123.036 2.491 . . . . 0.0 112.868 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -59.73 153.56 55.3 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.489 2.792 . . . . 0.0 113.51 173.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -65.79 148.71 86.82 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.318 2.679 . . . . 0.0 112.229 175.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.89 153.96 38.41 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.077 0.951 . . . . 0.0 113.251 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -85.63 15.84 4.35 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.439 1.496 . . . . 0.0 114.068 178.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.6 mt -66.42 139.88 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.252 1.421 . . . . 0.0 111.416 -175.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.5 m -133.67 135.36 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.033 1.733 . . . . 0.0 111.52 178.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.3 tttp -77.91 145.88 35.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.168 0.987 . . . . 0.0 110.873 172.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.9 m -141.73 155.5 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.777 1.631 . . . . 0.0 111.563 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.62 113.28 20.99 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.922 1.289 . . . . 0.0 109.992 174.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.7 mt -102.07 126.21 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.763 0.825 . . . . 0.0 110.839 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -82.9 143.1 30.96 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.722 1.609 . . . . 0.0 112.754 175.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -156.03 142.99 13.58 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.817 1.647 . . . . 0.0 110.429 170.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -63.24 143.9 90.55 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.699 2.266 . . . . 0.0 113.775 -174.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.84 71.42 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 115.476 0.95 . . . . 0.0 115.476 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -142.11 157.32 45.03 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.201 1.4 . . . . 0.0 112.641 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -70.21 154.1 94.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 123.762 0.825 . . . . 0.0 111.452 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.86 129.8 32.12 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.647 2.232 . . . . 0.0 112.746 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -81.15 109.63 15.88 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.095 0.958 . . . . 0.0 110.303 176.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.4 mt -76.91 126.16 30.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.48 0.712 . . . . 0.0 109.664 169.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.4 ptm -154.15 178.47 9.95 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.115 0.966 . . . . 0.0 111.766 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -115.96 137.72 51.85 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.401 1.081 . . . . 0.0 111.983 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.8 mt -105.33 114.03 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 C-N-CA 126.014 1.726 . . . . 0.0 108.717 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -87.53 119.93 28.33 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.887 0.875 . . . . 0.0 109.071 168.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -65.93 -15.07 62.64 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -83.95 -21.2 31.88 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.621 1.168 . . . . 0.0 113.977 172.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -80.2 146.97 63.81 Favored Pre-proline 0 N--CA 1.481 1.08 0 CA-C-N 119.386 0.994 . . . . 0.0 111.902 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.67 142.42 52.98 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.724 2.283 . . . . 0.0 111.06 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.5 mt -62.82 -29.61 70.86 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.298 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.6 p -60.83 -44.12 97.37 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.419 1.009 . . . . 0.0 112.576 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.87 87.63 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.574 0.625 . . . . 0.0 112.096 175.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.56 -48.38 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.345 0.658 . . . . 0.0 110.282 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -36.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.458 1.103 . . . . 0.0 111.213 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.68 -44.7 93.51 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.146 0.885 . . . . 0.0 112.066 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -66.51 -29.31 69.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.338 1.055 . . . . 0.0 113.074 174.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.92 -55.43 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.343 0.974 . . . . 0.0 110.514 169.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.07 -41.3 99.41 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.835 0.854 . . . . 0.0 112.182 -173.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.81 -27.29 68.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.634 0.774 . . . . 0.0 112.91 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.63 -23.58 67.15 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.425 1.012 . . . . 0.0 114.3 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -117.51 16.19 14.64 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.92 1.688 . . . . 0.0 113.144 172.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.1 m 55.59 26.42 9.14 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.92 1.688 . . . . 0.0 114.55 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.3 mt -72.46 125.41 27.35 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.113 1.365 . . . . 0.0 111.405 -178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.16 152.93 41.95 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.353 1.061 . . . . 0.0 112.352 176.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 49.27 68.11 0.78 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.458 1.903 . . . . 0.0 113.232 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -57.45 -17.25 12.29 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.971 1.308 . . . . 0.0 113.425 177.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -54.86 -27.93 46.21 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.705 1.602 . . . . 0.0 112.914 173.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -76.61 -18.37 58.65 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.938 0.895 . . . . 0.0 112.87 178.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -95.82 159.96 14.72 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -168.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.42 145.82 32.13 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.584 2.354 . . . . 0.0 109.563 172.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.46 154.96 28.53 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.456 0.646 . . . . 0.0 109.27 167.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -144.95 149.16 34.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 124.973 1.309 . . . . 0.0 110.019 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 -66.05 150.93 47.93 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.678 -0.639 . . . . 0.0 111.871 170.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.4 -21.02 1.05 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.357 1.063 . . . . 0.0 113.671 169.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -70.9 -72.55 0.2 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.466 1.106 . . . . 0.0 112.955 177.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 64.8 m -94.13 -19.11 21.1 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -172.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 t -161.36 -173.36 3.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.444 1.497 . . . . 0.0 111.35 -174.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -121.74 22.28 10.54 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.04 2.136 . . . . 0.0 112.6 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -61.38 136.94 58.21 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.7 -1.25 . . . . 0.0 111.925 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -70.22 141.54 52.5 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.736 -0.602 . . . . 0.0 109.712 168.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.6 mm -74.59 135.45 27.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.169 0.588 . . . . 0.0 110.291 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 p -142.12 173.02 11.9 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.775 2.03 . . . . 0.0 109.436 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -57.82 -22.69 48.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -90.32 -48.94 6.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.824 1.25 . . . . 0.0 112.362 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -74.79 -20.13 59.92 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.162 0.985 . . . . 0.0 113.306 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -54.99 -26.53 37.5 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.423 1.089 . . . . 0.0 113.843 171.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -72.6 -15.92 61.73 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.317 1.047 . . . . 0.0 113.376 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.22 -13.04 60.02 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.162 0.985 . . . . 0.0 112.894 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.0 mt -70.52 129.99 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.98 0.912 . . . . 0.0 109.65 174.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -111.47 165.29 12.11 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.247 1.819 . . . . 0.0 111.867 170.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -61.29 125.5 23.97 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.604 -0.685 . . . . 0.0 110.929 174.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.67 13.71 69.44 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.039 1.304 . . . . 0.0 115.392 -174.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.0 m -64.55 131.0 45.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 119.763 1.782 . . . . 0.0 111.69 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.6 mt -80.68 121.32 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 168.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -113.91 177.96 4.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.333 1.853 . . . . 0.0 110.455 176.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -143.18 136.27 27.98 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 126.813 2.045 . . . . 0.0 110.285 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.4 tp -82.11 137.65 34.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.274 0.63 . . . . 0.0 109.734 169.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.1 t -155.87 154.63 31.57 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.121 0.968 . . . . 0.0 110.241 -177.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.5 p -70.03 141.0 52.94 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.547 -1.346 . . . . 0.0 110.571 170.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.2 t -58.84 147.06 73.82 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 125.767 1.627 . . . . 0.0 113.164 -172.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.14 -21.8 55.14 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 122.808 2.339 . . . . 0.0 112.804 171.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -87.96 -59.33 2.27 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.834 1.254 . . . . 0.0 111.984 171.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 50.32 33.06 6.93 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.968 2.107 . . . . 0.0 115.242 -176.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -150.03 154.04 37.51 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.967 1.307 . . . . 0.0 111.712 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -150.12 81.95 1.37 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.78 1.632 . . . . 0.0 110.675 -178.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -62.54 -23.71 67.13 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 13.3 pm0 -77.3 -1.49 30.07 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.297 1.839 . . . . 0.0 114.779 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 60.3 tp -58.8 123.66 17.19 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.717 1.207 . . . . 0.0 112.822 -176.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -77.82 162.25 27.04 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.184 1.394 . . . . 0.0 113.287 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.8 mp0 -64.85 157.73 27.03 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.189 1.396 . . . . 0.0 112.848 173.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -64.27 139.84 58.81 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.785 1.234 . . . . 0.0 112.051 178.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.2 pt -136.19 159.18 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 126.5 1.92 . . . . 0.0 111.448 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -71.97 147.22 47.15 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.997 0.919 . . . . 0.0 112.269 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 64.3 m -100.51 149.73 23.4 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.953 1.301 . . . . 0.0 112.626 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 37.2 m -68.26 154.1 42.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.717 1.207 . . . . 0.0 112.8 174.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 93.3 p -138.3 -4.17 1.69 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -177.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 62.6 ttp -62.42 -27.21 68.94 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.026 -1.046 . . . . 0.0 113.464 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -68.16 -8.63 40.21 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.868 1.267 . . . . 0.0 114.348 178.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.32 -20.03 65.98 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 69.1 tttt 53.19 31.96 12.45 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.352 1.861 . . . . 0.0 113.798 177.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.9 pp -71.02 -8.63 54.71 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -169.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -82.15 12.9 3.8 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.679 1.592 . . . . 0.0 115.237 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.83 152.36 12.72 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.087 1.755 . . . . 0.0 113.724 171.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.6 mt -135.79 155.11 50.86 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.015 1.726 . . . . 0.0 111.596 179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.15 -9.76 1.74 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.954 1.835 . . . . 0.0 115.954 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -82.7 47.41 1.19 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.257 1.423 . . . . 0.0 112.874 -176.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.3 mp -75.29 147.37 40.25 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.019 1.328 . . . . 0.0 111.53 -178.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -152.11 160.21 43.47 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.269 1.428 . . . . 0.0 112.161 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.7 t -70.63 -32.8 70.24 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.026 0.93 . . . . 0.0 112.696 175.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.04 136.12 55.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.003 1.321 . . . . 0.0 111.82 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 27.1 m -63.21 140.05 58.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.591 1.157 . . . . 0.0 113.063 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -72.72 146.74 46.23 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.89 1.276 . . . . 0.0 111.588 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.16 1.384 . . . . 0.0 113.711 176.729 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 112.117 -0.393 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.9 ttp -65.65 136.41 95.98 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.334 1.054 . . . . 0.0 111.74 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.18 152.91 78.92 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.036 2.491 . . . . 0.0 112.705 177.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -70.33 156.62 61.45 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.434 2.756 . . . . 0.0 112.442 178.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -77.65 42.9 1.24 Allowed 'Trans proline' 0 CA--C 1.551 1.351 0 C-N-CA 124.78 3.653 . . . . 0.0 112.517 174.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -150.43 162.8 39.87 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.001 1.72 . . . . 0.0 112.009 -172.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 58.0 26.55 13.61 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.842 1.657 . . . . 0.0 114.332 -177.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 19.6 mt -106.25 144.24 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 125.35 1.46 . . . . 0.0 111.307 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.41 129.83 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 126.27 1.828 . . . . 0.0 110.867 175.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -73.61 143.32 46.41 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.956 0.902 . . . . 0.0 110.397 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.36 151.36 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.196 1.398 . . . . 0.0 111.171 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.09 129.01 56.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.526 1.13 . . . . 0.0 109.95 171.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -118.44 122.58 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.865 0.866 . . . . 0.0 110.821 -169.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -81.73 141.54 33.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.276 1.43 . . . . 0.0 112.86 175.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . 0.415 ' CD2' ' HD2' ' A' ' 15' ' ' PRO . 68.6 t-105 -158.84 139.53 9.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.677 1.991 . . . . 0.0 109.626 169.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.415 ' HD2' ' CD2' ' A' ' 14' ' ' TRP . 59.2 Cg_endo -68.08 150.59 77.49 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.131 2.554 . . . . 0.0 113.204 -173.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 73.46 9.96 78.55 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.188 0.899 . . . . 0.0 115.151 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.12 160.5 42.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.635 1.574 . . . . 0.0 112.248 -178.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -71.28 155.94 92.32 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.008 0.923 . . . . 0.0 111.743 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.36 126.95 22.24 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.871 2.381 . . . . 0.0 112.312 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -83.76 115.77 22.38 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.101 0.96 . . . . 0.0 110.973 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.48 130.93 35.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.247 0.619 . . . . 0.0 109.808 168.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -151.16 173.66 14.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.537 1.135 . . . . 0.0 110.998 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -126.79 114.23 17.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.21 1.004 . . . . 0.0 111.513 -173.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.7 mt -86.4 116.02 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 125.476 1.51 . . . . 0.0 109.744 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -82.51 117.84 22.81 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 167.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.0 -9.64 41.13 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -91.34 -19.89 22.44 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 170.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -87.16 148.58 45.32 Favored Pre-proline 0 N--CA 1.485 1.309 0 CA-C-N 120.225 1.375 . . . . 0.0 111.967 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.57 146.92 56.46 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.415 2.743 . . . . 0.0 112.577 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.84 -30.14 71.26 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 118.245 -0.883 . . . . 0.0 113.103 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.2 t -58.92 -45.23 90.83 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.991 1.269 . . . . 0.0 111.61 173.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.23 95.33 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.765 -0.584 . . . . 0.0 112.26 175.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 60.6 mt -60.9 -51.91 67.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.683 0.793 . . . . 0.0 111.251 175.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.4 mt -61.57 -39.83 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 123.943 0.897 . . . . 0.0 110.017 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -58.57 -43.61 89.45 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.758 0.708 . . . . 0.0 112.368 171.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -69.91 -26.33 64.11 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.565 1.146 . . . . 0.0 112.903 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.6 t -71.0 -61.39 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.919 0.888 . . . . 0.0 110.093 169.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -55.37 -39.2 69.82 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.56 1.544 . . . . 0.0 113.764 -173.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.87 -29.77 68.53 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.56 -29.79 72.94 Favored Glycine 0 CA--C 1.534 1.257 0 O-C-N 121.291 -0.881 . . . . 0.0 113.897 177.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -99.22 14.03 30.91 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.192 1.397 . . . . 0.0 112.883 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p 57.67 20.68 6.56 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.467 2.307 . . . . 0.0 115.322 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -72.39 113.42 9.42 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.877 1.271 . . . . 0.0 110.889 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.18 162.99 28.39 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.308 1.043 . . . . 0.0 112.207 174.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.5 m120 54.16 65.26 1.56 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.724 1.609 . . . . 0.0 112.777 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 32.3 p-80 -62.77 -14.34 43.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.353 1.061 . . . . 0.0 113.333 -177.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -54.57 -29.48 51.38 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.274 1.83 . . . . 0.0 113.407 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -74.98 -21.22 59.28 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.545 1.138 . . . . 0.0 112.86 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -98.24 160.01 14.57 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -168.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.24 156.42 39.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.305 2.242 . . . . 0.0 110.137 169.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.7 mt -80.32 154.53 27.73 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 167.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -142.17 144.8 33.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.655 1.182 . . . . 0.0 110.372 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -63.05 139.87 58.82 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.98 -23.94 6.72 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.92 1.288 . . . . 0.0 112.88 170.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -73.02 -6.35 44.92 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.609 1.164 . . . . 0.0 113.946 169.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.9 t -146.3 -166.25 2.42 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.036 1.734 . . . . 0.0 110.796 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 71.3 m -60.49 165.35 3.77 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.198 0.999 . . . . 0.0 112.113 170.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -71.35 45.11 0.1 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.569 1.948 . . . . 0.0 115.198 -171.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -67.96 118.49 11.22 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.59 -1.319 . . . . 0.0 110.857 173.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -67.67 141.67 56.61 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.866 0.467 . . . . 0.0 109.958 169.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mm -80.14 135.65 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.849 0.859 . . . . 0.0 110.409 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -143.78 168.93 18.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.15 2.18 . . . . 0.0 108.86 -177.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -61.3 -15.55 36.63 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.367 -0.833 . . . . 0.0 113.229 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -87.99 -50.4 6.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.321 1.448 . . . . 0.0 112.082 168.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -77.22 -19.63 56.41 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.992 1.317 . . . . 0.0 114.375 -168.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -58.32 -17.91 23.39 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -66.23 -19.21 65.76 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 173.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -75.43 -16.14 60.37 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.134 0.974 . . . . 0.0 113.113 173.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.9 mt -75.67 128.65 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 123.967 0.907 . . . . 0.0 109.688 177.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -120.6 168.38 11.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.255 1.822 . . . . 0.0 111.842 171.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -61.16 121.96 13.84 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.613 -0.679 . . . . 0.0 111.312 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.23 10.19 62.61 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.438 1.494 . . . . 0.0 115.594 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.0 m -64.81 131.33 46.5 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 119.692 1.746 . . . . 0.0 111.861 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 43.7 mt -87.2 125.9 40.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.85 0.86 . . . . 0.0 109.784 169.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.1 mt -124.79 176.75 6.39 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.877 2.471 . . . . 0.0 109.924 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt85 -136.61 149.07 47.81 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.846 1.259 . . . . 0.0 110.814 168.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.2 tp -82.98 138.81 33.63 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.52 156.53 32.19 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.165 0.986 . . . . 0.0 110.67 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 26.8 p -70.63 132.44 45.45 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.62 -1.3 . . . . 0.0 110.418 169.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 p -68.47 164.78 41.13 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 125.339 1.456 . . . . 0.0 112.498 -176.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.85 -25.43 9.08 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 122.534 2.156 . . . . 0.0 113.281 172.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.97 -41.17 10.16 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.586 1.154 . . . . 0.0 113.974 -174.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 49.57 -117.41 0.99 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.216 1.807 . . . . 0.0 112.488 178.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -102.65 9.31 39.35 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.401 1.48 . . . . 0.0 113.8 -175.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.76 124.55 23.61 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.259 -0.9 . . . . 0.0 112.376 -177.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 60.12 163.93 0.06 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 127.327 2.251 . . . . 0.0 115.173 -175.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -69.99 136.84 50.88 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.11 -0.994 . . . . 0.0 110.958 172.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.3 mp -73.92 151.81 40.29 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.156 0.983 . . . . 0.0 112.097 179.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.401 ' CE1' ' HE ' ' A' ' 91' ' ' ARG . 5.7 p80 -151.09 147.32 26.93 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.746 1.618 . . . . 0.0 111.439 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.57 34.76 0.59 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.04 1.336 . . . . 0.0 113.145 -176.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.401 ' HE ' ' CE1' ' A' ' 89' ' ' HIS . 37.2 ttm-85 -62.24 -15.69 48.69 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 127.045 2.138 . . . . 0.0 115.021 -171.18 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.7 pt -70.2 -13.58 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.932 1.693 . . . . 0.0 113.817 173.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -63.52 148.37 48.91 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.146 0.978 . . . . 0.0 113.054 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.2 t -158.83 150.93 21.23 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.989 1.316 . . . . 0.0 111.903 177.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.7 m -75.32 -13.75 60.44 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.539 1.135 . . . . 0.0 113.363 169.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 86.3 p -72.25 161.76 30.41 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.615 1.166 . . . . 0.0 113.437 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -150.56 156.12 40.77 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.553 1.541 . . . . 0.0 111.461 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -140.07 11.06 2.39 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.991 1.316 . . . . 0.0 114.151 -176.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -151.51 155.79 39.23 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.377 1.471 . . . . 0.0 112.193 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -130.13 26.31 5.18 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 126.107 1.763 . . . . 0.0 112.724 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.6 mt -79.58 -5.52 55.13 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.631 1.572 . . . . 0.0 114.751 -171.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -63.22 137.21 58.13 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.23 1.012 . . . . 0.0 112.789 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.48 147.13 46.36 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.951 0.901 . . . . 0.0 112.706 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -116.89 9.2 13.74 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.484 1.514 . . . . 0.0 113.374 -179.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -67.34 136.22 54.49 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.128 1.371 . . . . 0.0 112.154 -176.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -84.42 147.28 27.2 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.54 1.136 . . . . 0.0 111.721 173.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.6 mp -103.73 -18.46 14.68 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.626 1.57 . . . . 0.0 112.787 174.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -77.7 169.1 18.88 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.526 1.13 . . . . 0.0 112.95 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.9 t -148.64 146.64 28.28 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.21 1.404 . . . . 0.0 111.92 176.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.6 -3.18 52.66 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.944 1.298 . . . . 0.0 113.943 173.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 23.7 t -65.83 136.25 55.92 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.012 0.925 . . . . 0.0 112.341 -179.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.66 153.27 35.34 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.009 1.324 . . . . 0.0 112.738 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.9 t0 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 126.018 1.727 . . . . 0.0 112.814 175.285 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.638 0 N-CA-C 111.948 -0.461 . . . . 0.0 111.948 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.1 mtp -70.41 155.99 92.58 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.117 0.967 . . . . 0.0 112.526 177.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -53.36 121.71 9.93 Favored 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 124.092 3.195 . . . . 0.0 112.923 175.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -67.87 145.76 69.59 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 122.606 2.204 . . . . 0.0 113.878 -175.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -65.71 146.98 85.36 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 122.991 2.46 . . . . 0.0 112.206 176.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 60.16 0.7 0.3 Allowed 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -92.25 14.36 16.5 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.677 1.591 . . . . 0.0 112.693 169.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.0 mt -129.15 136.74 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.587 1.555 . . . . 0.0 110.15 -170.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 10.3 m -129.79 127.47 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.19 1.396 . . . . 0.0 111.594 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -75.83 141.56 42.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.006 0.922 . . . . 0.0 111.03 175.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -140.68 156.83 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.498 1.519 . . . . 0.0 111.936 -176.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.28 116.24 26.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.789 1.235 . . . . 0.0 109.945 170.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.71 126.1 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 124.303 1.041 . . . . 0.0 110.568 -171.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -84.56 146.92 27.29 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.262 1.425 . . . . 0.0 113.147 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -153.34 142.18 14.43 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 125.941 1.696 . . . . 0.0 110.167 169.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -62.07 138.67 74.33 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.66 2.24 . . . . 0.0 113.592 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.73 13.21 71.58 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.355 0.902 . . . . 0.0 115.355 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.8 154.22 50.6 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.263 1.425 . . . . 0.0 112.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -68.56 148.35 98.1 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 123.522 0.729 . . . . 0.0 111.059 170.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.34 129.91 33.5 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.548 2.165 . . . . 0.0 113.064 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -81.08 111.62 17.7 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.64 1.176 . . . . 0.0 110.347 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -77.03 127.51 32.81 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.328 0.651 . . . . 0.0 109.651 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -154.86 178.18 10.45 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.014 0.925 . . . . 0.0 111.833 173.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -115.8 136.44 53.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.453 1.101 . . . . 0.0 111.924 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.0 mt -105.1 107.43 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 125.794 1.637 . . . . 0.0 108.225 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -78.34 117.04 19.2 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 168.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -67.07 -13.39 61.88 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -87.36 -21.96 25.35 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.188 0.995 . . . . 0.0 113.681 173.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -75.99 148.35 81.49 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 124.469 1.108 . . . . 0.0 111.852 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.02 139.34 42.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.978 2.452 . . . . 0.0 111.04 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.4 mt -61.44 -31.13 71.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.35 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.7 t -60.02 -44.51 94.56 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.56 1.073 . . . . 0.0 112.291 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -39.84 93.5 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.659 -0.651 . . . . 0.0 112.026 175.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.5 mt -65.03 -46.49 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.166 0.586 . . . . 0.0 110.619 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.1 mt -60.26 -38.2 76.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.658 1.183 . . . . 0.0 111.138 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -61.69 -40.15 93.97 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.4 0.68 . . . . 0.0 112.316 172.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -69.31 -25.66 64.34 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.396 1.078 . . . . 0.0 113.167 173.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.35 -58.99 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.438 1.017 . . . . 0.0 110.564 169.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.3 p -65.08 -35.05 79.92 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.238 0.615 . . . . 0.0 112.348 -169.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.53 -29.0 68.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.055 0.942 . . . . 0.0 112.922 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -22.98 68.47 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.421 1.01 . . . . 0.0 114.263 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -115.48 10.71 15.78 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.022 1.729 . . . . 0.0 113.053 172.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.1 t 54.96 31.1 15.29 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.049 1.74 . . . . 0.0 114.169 -175.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.41 125.42 29.51 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.707 1.203 . . . . 0.0 109.908 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.83 159.23 30.24 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 113.586 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 51.6 75.78 0.19 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.081 2.153 . . . . 0.0 113.325 170.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -62.33 -17.82 59.81 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.485 1.114 . . . . 0.0 113.661 -173.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -55.31 -30.88 61.07 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.224 1.41 . . . . 0.0 112.68 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -73.55 -23.49 59.98 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.155 0.582 . . . . 0.0 112.22 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -94.85 158.03 15.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.801 1.24 . . . . 0.0 114.331 -169.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.71 148.41 35.66 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.731 2.013 . . . . 0.0 109.748 169.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.29 148.33 35.76 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 167.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -141.39 153.99 45.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.344 1.458 . . . . 0.0 109.375 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -68.72 148.47 50.33 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.314 -0.866 . . . . 0.0 112.427 171.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.22 -25.56 4.84 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.317 1.447 . . . . 0.0 111.265 167.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -62.92 -49.76 73.5 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.617 0.767 . . . . 0.0 109.227 167.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.9 t -88.58 155.24 19.74 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.523 1.129 . . . . 0.0 109.161 165.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.0 m -60.59 -48.94 79.56 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -168.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -155.06 13.7 0.39 Allowed 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 -169.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.2 m-30 -66.27 118.29 9.75 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 120.084 1.311 . . . . 0.0 111.476 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -70.89 145.83 49.96 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.421 -0.799 . . . . 0.0 111.553 172.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.82 131.15 34.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.096 0.958 . . . . 0.0 110.238 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -146.9 169.48 19.07 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.155 1.782 . . . . 0.0 110.102 -176.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -60.03 -18.0 43.03 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.734 -1.229 . . . . 0.0 113.458 172.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -96.0 -8.06 34.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.988 1.715 . . . . 0.0 114.296 175.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -133.69 -13.28 2.58 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 -172.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -59.95 -23.31 63.46 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 120.581 -1.324 . . . . 0.0 114.105 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -61.78 -22.69 65.65 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.394 1.478 . . . . 0.0 113.279 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -73.75 -19.55 60.75 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.641 0.777 . . . . 0.0 112.863 177.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 51.3 mt -68.76 132.71 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.97 0.908 . . . . 0.0 109.603 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -135.48 165.51 25.34 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.651 1.98 . . . . 0.0 111.882 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -57.62 116.04 3.15 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.332 0.653 . . . . 0.0 111.362 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.15 11.58 56.03 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.59 1.567 . . . . 0.0 115.568 -176.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.9 m -65.85 133.12 50.28 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.606 1.703 . . . . 0.0 111.781 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -85.19 121.97 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 170.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -118.7 -179.89 3.94 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.734 2.013 . . . . 0.0 110.873 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -148.55 137.45 21.6 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 127.331 2.252 . . . . 0.0 110.256 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 tp -85.27 137.88 32.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.754 0.821 . . . . 0.0 109.993 169.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.2 t -157.19 151.86 25.5 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.812 0.845 . . . . 0.0 110.917 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.3 p -71.03 132.63 45.43 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.988 -1.07 . . . . 0.0 110.298 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.9 p -68.47 162.29 63.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.462 1.505 . . . . 0.0 114.199 -169.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -63.86 -28.59 67.51 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.551 2.167 . . . . 0.0 112.609 168.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.74 -37.96 70.5 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.195 1.398 . . . . 0.0 114.118 -173.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -66.04 -11.43 48.29 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -176.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -68.67 -11.76 60.56 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.227 1.011 . . . . 0.0 113.501 170.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.36 -176.56 4.57 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.336 1.855 . . . . 0.0 111.767 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -71.86 8.95 1.02 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 126.003 1.721 . . . . 0.0 114.363 179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -77.3 46.16 0.5 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.676 1.99 . . . . 0.0 113.339 -176.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.4 mp -67.99 149.72 49.37 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.971 1.308 . . . . 0.0 111.432 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -73.0 153.04 41.09 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.512 1.125 . . . . 0.0 113.522 -174.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -152.22 157.5 41.54 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.509 1.524 . . . . 0.0 110.408 169.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -79.33 67.91 5.19 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.511 1.124 . . . . 0.0 112.754 -173.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.8 mm -62.63 140.7 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.72 1.208 . . . . 0.0 110.02 169.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 33.1 tp60 -62.89 131.13 47.72 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.593 0.757 . . . . 0.0 111.964 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.1 t -154.78 154.76 33.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.676 1.59 . . . . 0.0 110.77 178.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 99.0 p -152.28 160.97 43.25 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.088 1.355 . . . . 0.0 112.111 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.4 t -153.73 138.68 17.22 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.866 1.266 . . . . 0.0 111.225 -177.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 51.3 tpp -81.17 148.51 29.52 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.683 1.193 . . . . 0.0 111.953 175.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -66.79 149.2 50.89 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.983 0.913 . . . . 0.0 112.218 175.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -126.73 28.85 5.8 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.542 1.537 . . . . 0.0 112.542 -176.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -54.38 123.11 11.95 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.836 1.654 . . . . 0.0 111.83 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.4 tp -157.69 140.86 15.26 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.702 1.601 . . . . 0.0 110.585 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -69.93 131.08 43.87 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.5 0.72 . . . . 0.0 111.38 174.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -153.52 156.9 38.94 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.518 1.127 . . . . 0.0 112.792 -174.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.2 mt -137.67 160.39 39.34 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.439 1.895 . . . . 0.0 111.18 178.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -144.22 143.48 31.07 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.76 1.624 . . . . 0.0 110.835 178.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 20.1 p-10 -83.02 75.77 9.88 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.879 1.672 . . . . 0.0 111.546 174.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.41 153.83 30.11 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.003 0.921 . . . . 0.0 111.985 175.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.88 -22.07 63.92 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.2 p -64.4 -18.53 64.79 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.274 1.43 . . . . 0.0 114.182 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.97 -20.14 59.79 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.861 0.864 . . . . 0.0 112.665 172.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 24.1 t -66.85 132.95 49.07 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.794 0.838 . . . . 0.0 111.512 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -159.06 157.26 30.77 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.464 1.505 . . . . 0.0 112.658 -169.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.088 1.755 . . . . 0.0 113.15 175.892 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.559 0 N-CA-C 111.975 -0.45 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt 51.35 66.99 4.63 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.369 1.868 . . . . 0.0 113.862 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -67.88 166.23 25.26 Favored 'Trans proline' 0 CA--C 1.548 1.194 0 C-N-CA 123.475 2.783 . . . . 0.0 112.75 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -58.5 158.51 23.03 Favored 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 123.632 2.888 . . . . 0.0 113.855 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -56.72 136.78 78.17 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.68 2.92 . . . . 0.0 114.222 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -80.27 74.81 7.08 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.901 1.28 . . . . 0.0 111.751 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -73.43 33.86 0.08 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 125.993 1.717 . . . . 0.0 114.282 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.5 mt -81.16 138.81 19.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 125.673 1.589 . . . . 0.0 109.746 176.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 m -129.44 132.17 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.937 1.295 . . . . 0.0 112.01 -177.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -69.15 146.42 52.49 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.761 0.824 . . . . 0.0 110.756 170.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m -143.69 151.58 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.408 1.483 . . . . 0.0 111.521 176.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.87 116.75 28.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.665 1.186 . . . . 0.0 109.854 173.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.7 mt -106.7 123.96 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.907 0.883 . . . . 0.0 110.823 -169.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -82.7 144.69 30.06 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.236 1.414 . . . . 0.0 112.933 174.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -154.83 143.44 14.67 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 126.003 1.721 . . . . 0.0 110.079 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -63.02 143.21 90.46 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.605 2.203 . . . . 0.0 113.789 -173.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.5 12.27 73.2 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 178.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.91 155.79 45.5 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.181 1.392 . . . . 0.0 112.702 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -69.47 152.86 96.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 123.803 0.841 . . . . 0.0 111.371 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.99 128.9 29.52 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.596 2.198 . . . . 0.0 113.17 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -78.29 111.32 14.14 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.623 1.169 . . . . 0.0 110.148 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.3 127.67 32.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.316 0.646 . . . . 0.0 109.584 169.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.4 ptm -152.63 -178.52 6.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.035 0.934 . . . . 0.0 111.67 172.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -122.44 129.64 52.26 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.49 1.116 . . . . 0.0 111.572 178.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.2 mt -96.26 112.87 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 C-N-CA 125.311 1.444 . . . . 0.0 108.664 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.99 120.47 26.15 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 167.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -64.92 -11.09 34.28 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -87.22 -21.9 25.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.944 1.298 . . . . 0.0 114.345 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -77.97 141.87 63.88 Favored Pre-proline 0 N--CA 1.483 1.191 0 CA-C-N 119.831 1.196 . . . . 0.0 111.513 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.19 144.22 56.32 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.333 2.688 . . . . 0.0 111.543 177.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.1 mt -63.72 -29.97 71.13 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.071 -0.966 . . . . 0.0 113.097 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.0 t -61.13 -44.82 96.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.397 1.453 . . . . 0.0 111.898 174.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.11 95.52 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.567 -0.708 . . . . 0.0 112.194 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.12 -50.41 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.399 0.679 . . . . 0.0 110.502 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.01 -35.66 69.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.299 1.04 . . . . 0.0 110.946 -179.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.02 -43.33 95.34 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.041 0.837 . . . . 0.0 112.081 170.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -68.74 -29.69 68.16 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.732 1.213 . . . . 0.0 113.121 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.16 -53.66 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 121.292 -0.88 . . . . 0.0 110.155 169.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.0 m -61.4 -43.73 98.37 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.161 0.984 . . . . 0.0 111.986 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -60.34 -29.72 69.07 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.098 0.959 . . . . 0.0 112.847 175.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.32 -23.58 62.45 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.395 0.998 . . . . 0.0 114.436 173.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.71 16.86 14.45 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.97 1.708 . . . . 0.0 113.25 171.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.0 p 56.33 21.02 5.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.281 2.232 . . . . 0.0 115.536 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -68.41 123.92 22.1 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.447 1.499 . . . . 0.0 111.423 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.89 158.73 31.72 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.445 1.098 . . . . 0.0 112.365 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 50.52 68.41 0.77 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.491 1.916 . . . . 0.0 112.998 173.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -62.2 -15.72 48.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.558 1.143 . . . . 0.0 113.158 -177.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -55.99 -26.92 50.59 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.754 1.622 . . . . 0.0 113.197 176.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -77.77 -15.9 58.77 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -98.18 157.65 16.03 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -168.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.65 149.24 35.35 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 127.297 2.239 . . . . 0.0 109.53 169.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -78.39 157.16 29.14 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -145.85 147.82 32.22 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.792 1.237 . . . . 0.0 110.157 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -65.19 125.98 26.69 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.629 -0.669 . . . . 0.0 110.906 173.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.79 -27.41 50.16 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -171.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -77.89 69.69 4.16 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.085 1.354 . . . . 0.0 112.811 -170.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.5 p 60.22 -14.81 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 129.294 3.038 . . . . 0.0 117.198 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.4 t -66.72 148.28 52.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.514 1.526 . . . . 0.0 113.282 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.2 p-10 -87.01 -5.54 59.04 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.432 1.093 . . . . 0.0 113.608 170.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -63.55 107.1 1.06 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.511 1.051 . . . . 0.0 112.861 -169.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -70.05 146.35 51.04 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.755 0.822 . . . . 0.0 110.005 168.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.1 mm -80.6 136.64 22.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.115 0.966 . . . . 0.0 110.083 175.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.0 p -144.43 169.51 17.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.236 2.214 . . . . 0.0 108.553 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -62.19 -11.78 16.41 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 177.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.76 -44.97 6.85 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.352 1.461 . . . . 0.0 112.509 168.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -76.25 -21.64 56.11 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.486 1.114 . . . . 0.0 113.509 -172.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -57.15 -22.23 38.63 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 176.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -66.86 -18.51 65.41 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.401 1.081 . . . . 0.0 113.377 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -79.83 -11.26 59.83 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.288 1.035 . . . . 0.0 113.452 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.4 mt -76.14 133.03 31.99 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.311 1.044 . . . . 0.0 109.651 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.75 166.89 15.39 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.724 2.01 . . . . 0.0 111.804 173.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -60.65 118.89 7.13 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.823 -0.548 . . . . 0.0 111.41 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.16 14.34 56.17 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 125.293 1.425 . . . . 0.0 115.436 -175.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -65.33 130.62 43.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.77 1.785 . . . . 0.0 111.28 177.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mt -84.29 121.92 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 170.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -117.88 174.62 6.08 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.255 1.822 . . . . 0.0 110.671 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -141.92 133.84 27.33 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 126.239 1.816 . . . . 0.0 109.976 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 tp -79.47 136.8 37.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.194 0.598 . . . . 0.0 110.138 170.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.3 t -157.53 151.0 23.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.421 1.088 . . . . 0.0 110.11 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.9 p -72.0 138.57 48.06 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.493 -1.38 . . . . 0.0 110.388 169.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p -65.93 162.23 47.45 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 123.954 0.902 . . . . 0.0 112.234 -175.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -56.49 -24.38 52.67 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.302 2.668 . . . . 0.0 115.053 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -104.08 -4.93 22.6 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.546 1.538 . . . . 0.0 114.173 176.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 49.91 38.04 15.16 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.873 1.669 . . . . 0.0 112.789 -168.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -148.61 164.85 33.03 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.639 2.376 . . . . 0.0 110.242 -177.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.55 -34.14 75.06 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -176.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -80.23 111.04 16.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.075 0.95 . . . . 0.0 109.334 168.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.3 pm0 -73.92 -19.91 60.54 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.9 135.52 33.28 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.236 1.414 . . . . 0.0 112.952 -177.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 27.2 p80 -84.48 -10.27 57.62 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.799 1.24 . . . . 0.0 113.513 169.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -65.5 145.5 56.03 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.177 1.391 . . . . 0.0 113.175 -177.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -135.38 136.17 41.24 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.13 1.772 . . . . 0.0 111.231 -178.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 99.5 mt -77.55 -46.11 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.126 0.971 . . . . 0.0 111.619 -176.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -151.99 149.38 28.82 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.648 1.179 . . . . 0.0 112.705 -177.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 87.7 p -75.03 171.74 13.57 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.611 1.564 . . . . 0.0 113.195 175.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.6 t -145.43 156.47 43.77 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.642 1.577 . . . . 0.0 111.052 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 80.1 p -67.76 -31.25 71.03 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.185 0.994 . . . . 0.0 113.124 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 78.1 mtm -147.28 108.72 4.3 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.633 1.573 . . . . 0.0 111.27 176.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -76.45 -32.78 58.62 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.276 0.63 . . . . 0.0 112.119 169.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.43 60.77 2.68 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.823 1.649 . . . . 0.0 112.285 178.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -58.19 -25.03 61.08 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.224 1.41 . . . . 0.0 114.364 -176.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -76.1 -10.22 59.24 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.373 1.869 . . . . 0.0 115.048 176.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -68.2 142.04 55.8 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.314 0.961 . . . . 0.0 112.913 -177.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -148.63 164.16 35.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.737 1.615 . . . . 0.0 111.719 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.72 159.97 43.62 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.568 1.547 . . . . 0.0 112.088 -177.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -71.57 155.19 40.83 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.796 1.239 . . . . 0.0 112.53 178.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -69.18 157.24 37.28 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.241 1.016 . . . . 0.0 112.378 171.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 pp -147.69 166.96 25.88 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.34 1.456 . . . . 0.0 112.191 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -148.03 166.66 27.08 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.67 1.588 . . . . 0.0 111.888 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.3 t -148.39 160.24 43.22 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.779 1.231 . . . . 0.0 112.572 -177.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.4 mt -76.13 -5.57 47.23 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.257 1.423 . . . . 0.0 113.405 173.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 91.5 p -69.56 -14.56 62.91 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.197 1.399 . . . . 0.0 114.554 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -64.52 150.07 47.43 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.665 1.586 . . . . 0.0 112.628 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.0 t0 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 125.899 1.679 . . . . 0.0 112.906 176.077 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.604 0 N-CA-C 112.066 -0.414 . . . . 0.0 112.066 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.0 ptm -66.26 151.25 96.08 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 124.095 0.958 . . . . 0.0 112.774 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.73 153.05 76.95 Favored 'Trans proline' 0 CA--C 1.546 1.122 0 C-N-CA 122.906 2.404 . . . . 0.0 112.206 173.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -70.29 155.74 63.5 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.371 2.714 . . . . 0.0 112.648 177.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -69.15 162.19 42.76 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.596 2.864 . . . . 0.0 112.462 173.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -146.69 153.59 40.45 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.129 1.371 . . . . 0.0 112.077 177.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 51.2 p-10 -106.11 9.32 32.38 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.09 1.756 . . . . 0.0 114.037 -177.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.1 mt -71.04 137.32 24.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.95 1.3 . . . . 0.0 109.243 174.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 m -129.02 123.3 58.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.484 1.114 . . . . 0.0 112.745 -173.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -72.86 137.72 45.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.37 1.468 . . . . 0.0 111.261 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.7 m -139.34 157.01 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.511 1.524 . . . . 0.0 111.956 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.54 118.47 32.73 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.817 1.247 . . . . 0.0 109.837 171.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.5 mt -106.03 123.97 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.805 0.842 . . . . 0.0 110.882 -171.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -85.53 143.57 28.43 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.062 1.745 . . . . 0.0 113.025 176.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -156.46 142.09 12.7 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.086 1.754 . . . . 0.0 110.1 169.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -59.12 145.88 96.25 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.999 2.466 . . . . 0.0 114.493 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.1 11.46 74.89 Favored Glycine 0 CA--C 1.539 1.56 0 N-CA-C 115.607 1.003 . . . . 0.0 115.607 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -144.72 158.6 43.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.104 1.361 . . . . 0.0 112.695 -177.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -70.65 155.42 93.42 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.012 0.925 . . . . 0.0 111.662 170.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -60.65 130.18 32.31 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.653 2.235 . . . . 0.0 112.732 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -82.74 108.74 16.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.354 1.061 . . . . 0.0 110.453 176.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.7 mt -76.4 128.03 34.03 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 110.17 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -155.3 175.37 13.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.411 1.084 . . . . 0.0 111.638 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -122.71 118.32 27.81 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.383 1.073 . . . . 0.0 111.584 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.8 mt -83.79 110.54 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 125.227 1.411 . . . . 0.0 108.848 175.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -81.95 116.48 21.6 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 169.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.68 -12.71 55.92 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.0 -26.63 26.97 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.35 0.977 . . . . 0.0 113.489 171.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -77.45 142.48 67.06 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.02 0.928 . . . . 0.0 111.396 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.22 143.15 63.48 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.12 2.547 . . . . 0.0 111.296 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.2 mt -60.69 -31.39 70.64 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.442 178.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.8 p -59.18 -45.4 91.12 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.597 1.09 . . . . 0.0 112.45 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.77 89.48 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.178 0.591 . . . . 0.0 112.109 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.73 -47.54 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.647 0.779 . . . . 0.0 110.843 177.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.52 -37.73 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.589 1.156 . . . . 0.0 110.761 178.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -62.93 -38.47 91.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 172.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -71.02 -23.94 62.27 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.262 1.025 . . . . 0.0 113.074 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 73.2 t -73.14 -62.32 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 O-C-N 121.107 -0.996 . . . . 0.0 111.005 169.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.8 p -59.74 -30.98 69.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.94 1.296 . . . . 0.0 113.652 -169.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.85 -28.38 67.47 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.573 1.149 . . . . 0.0 113.346 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.68 -26.08 74.83 Favored Glycine 0 CA--C 1.534 1.232 0 O-C-N 121.332 -0.855 . . . . 0.0 114.011 177.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.0 m0 -107.67 11.09 28.77 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.668 1.587 . . . . 0.0 112.84 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.8 m 55.41 29.23 12.77 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.157 1.783 . . . . 0.0 114.065 -176.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -80.51 121.01 25.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.602 1.161 . . . . 0.0 110.332 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.7 165.85 23.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.78 1.232 . . . . 0.0 113.214 -178.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 54.15 63.75 2.07 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.037 1.735 . . . . 0.0 113.417 173.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -59.77 -21.8 61.26 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.958 0.903 . . . . 0.0 113.35 -176.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -55.95 -28.92 59.14 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.211 1.405 . . . . 0.0 113.127 172.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -77.77 -16.81 58.12 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.785 0.834 . . . . 0.0 112.624 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -96.99 159.64 14.79 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -169.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.27 156.35 43.31 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.152 2.581 . . . . 0.0 109.78 171.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.0 mt -89.5 156.02 18.91 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 166.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -148.25 147.34 29.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.979 0.912 . . . . 0.0 110.998 -177.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 52.2 m-70 -65.9 130.53 43.58 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.336 0.654 . . . . 0.0 112.036 174.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.75 2.55 50.91 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.321 1.048 . . . . 0.0 113.198 169.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -65.89 179.96 0.81 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.656 1.982 . . . . 0.0 112.842 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -58.09 -11.58 2.67 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.017 1.727 . . . . 0.0 115.269 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.0 t -136.57 129.17 30.45 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.241 1.416 . . . . 0.0 110.164 168.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -90.51 60.15 4.52 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.246 1.418 . . . . 0.0 112.59 -169.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -64.32 134.38 54.54 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.434 -0.791 . . . . 0.0 111.164 172.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -71.77 145.92 48.41 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 121.682 -0.636 . . . . 0.0 110.93 169.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mm -82.14 130.22 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 123.988 0.915 . . . . 0.0 109.545 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.5 p -143.69 166.77 23.94 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.786 1.634 . . . . 0.0 109.78 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.57 -13.16 27.97 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.853 -1.154 . . . . 0.0 113.345 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -97.91 -13.59 21.12 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.123 1.769 . . . . 0.0 114.417 173.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -126.3 -11.74 6.31 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -60.74 -18.88 57.38 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -62.4 -22.13 65.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.807 1.243 . . . . 0.0 113.112 174.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -75.02 -13.15 60.47 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.062 0.945 . . . . 0.0 113.357 177.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 65.3 mt -73.37 134.48 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.321 1.049 . . . . 0.0 110.079 175.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -126.85 166.38 17.57 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.227 1.811 . . . . 0.0 111.442 174.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -56.92 125.09 20.96 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.761 -0.587 . . . . 0.0 111.321 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.7 9.29 68.89 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.238 1.399 . . . . 0.0 115.343 -176.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 99.0 m -66.0 130.07 41.99 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.498 1.649 . . . . 0.0 111.255 177.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.8 mt -87.0 124.77 40.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 170.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.4 mt -118.21 172.46 7.42 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.239 1.815 . . . . 0.0 110.723 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.7 ttt-85 -132.11 140.38 48.79 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 126.745 2.018 . . . . 0.0 110.049 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.96 140.19 38.07 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 167.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -158.25 152.84 24.69 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.308 -0.87 . . . . 0.0 111.028 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.1 p -73.6 135.15 43.83 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.568 -1.332 . . . . 0.0 110.856 170.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.3 t -71.46 145.71 90.68 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 126.434 1.893 . . . . 0.0 114.421 -168.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.23 -16.94 53.57 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.592 2.194 . . . . 0.0 112.665 168.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.28 12.88 14.82 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.787 1.635 . . . . 0.0 114.733 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -57.26 152.32 14.17 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.054 -1.029 . . . . 0.0 112.873 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -143.21 138.29 29.58 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.527 1.531 . . . . 0.0 110.652 -177.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.19 -14.86 61.44 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.707 1.203 . . . . 0.0 114.115 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -58.3 132.02 52.37 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.9 1.28 . . . . 0.0 112.252 177.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -72.36 142.25 48.77 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.099 0.96 . . . . 0.0 111.685 174.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.9 mt -130.81 165.99 21.8 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.251 1.821 . . . . 0.0 112.003 -174.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 35.6 p80 -143.4 163.07 34.08 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.679 1.592 . . . . 0.0 111.732 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -154.1 168.11 27.58 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.946 1.298 . . . . 0.0 112.608 -175.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -138.06 138.18 38.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.376 1.87 . . . . 0.0 110.371 173.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 99.0 mt -72.33 124.94 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.993 0.917 . . . . 0.0 110.227 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 66.8 tp60 -79.96 130.5 35.33 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.428 1.091 . . . . 0.0 111.286 174.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 34.5 t -72.94 135.27 45.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.517 0.727 . . . . 0.0 111.363 171.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 25.4 t -159.94 152.47 21.1 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.926 1.29 . . . . 0.0 111.81 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.0 m -142.89 139.96 31.01 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.677 1.591 . . . . 0.0 111.097 177.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.9 ptm -158.35 172.66 17.96 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.287 1.435 . . . . 0.0 112.034 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 56.2 p30 -135.33 164.98 26.52 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.87 1.668 . . . . 0.0 111.74 170.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -154.6 166.13 34.33 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.075 1.35 . . . . 0.0 112.365 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -62.77 146.11 53.27 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.866 1.267 . . . . 0.0 111.518 173.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.4 mt -64.73 148.28 51.44 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.355 1.062 . . . . 0.0 112.672 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -72.36 158.58 35.52 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.579 1.152 . . . . 0.0 113.703 177.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -142.61 160.92 39.36 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.273 1.829 . . . . 0.0 111.006 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.82 137.07 57.55 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.856 0.862 . . . . 0.0 112.336 -177.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -90.72 -8.08 50.81 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.921 1.288 . . . . 0.0 113.863 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -75.3 -8.79 57.6 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.269 1.428 . . . . 0.0 114.691 -172.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -77.49 46.88 0.55 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.109 1.764 . . . . 0.0 112.971 -175.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -77.76 -7.36 56.45 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.78 1.632 . . . . 0.0 114.2 175.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.8 m 64.53 160.64 0.11 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 127.448 2.299 . . . . 0.0 115.111 -173.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 57.0 tp -67.74 141.7 56.51 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.772 1.229 . . . . 0.0 112.021 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 56.7 p -62.13 146.08 51.55 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.711 1.204 . . . . 0.0 112.8 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -116.7 7.09 13.41 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.95 1.7 . . . . 0.0 114.03 -176.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 . . . . . 0 C--O 1.251 1.173 0 C-N-CA 125.58 1.552 . . . . 0.0 113.562 177.85 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 54.1 mt . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.6 m -131.94 129.9 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.029 1.331 . . . . 0.0 112.399 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -76.35 141.61 41.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.123 0.969 . . . . 0.0 111.264 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.87 156.11 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.753 1.621 . . . . 0.0 111.512 -177.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.89 121.58 41.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.669 1.188 . . . . 0.0 109.786 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.9 mt -109.68 125.42 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.224 1.01 . . . . 0.0 110.474 -170.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -81.55 148.28 29.23 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.167 1.387 . . . . 0.0 113.375 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -155.89 142.9 13.6 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.108 1.763 . . . . 0.0 110.093 168.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -60.56 140.14 89.67 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.756 2.304 . . . . 0.0 113.823 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.58 12.84 70.69 Favored Glycine 0 CA--C 1.539 1.577 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.96 153.58 48.2 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.173 1.389 . . . . 0.0 112.611 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -69.59 150.07 96.86 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.492 0.717 . . . . 0.0 110.936 169.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -59.66 131.07 38.11 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.39 2.06 . . . . 0.0 113.332 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -80.05 114.51 19.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.721 1.209 . . . . 0.0 110.429 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.36 129.96 35.59 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.282 0.633 . . . . 0.0 109.706 169.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 23.9 ptm -154.68 177.13 11.58 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.117 0.967 . . . . 0.0 111.689 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -119.3 124.03 45.67 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.23 1.012 . . . . 0.0 111.211 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.7 mt -90.72 110.06 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 125.531 1.532 . . . . 0.0 108.575 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.1 t0 -83.33 118.3 23.59 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.731 0.813 . . . . 0.0 109.774 169.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -65.47 -12.33 51.59 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.12 -25.19 29.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.597 1.089 . . . . 0.0 113.716 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -78.29 148.76 74.82 Favored Pre-proline 0 N--CA 1.48 1.042 0 C-N-CA 124.455 1.102 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.44 141.75 47.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.888 2.392 . . . . 0.0 110.963 173.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -61.49 -30.96 70.94 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 123.107 0.563 . . . . 0.0 112.293 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -59.45 -43.96 93.06 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.038 0.836 . . . . 0.0 112.53 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.76 81.4 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.944 -0.472 . . . . 0.0 111.985 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.06 -48.43 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.33 0.652 . . . . 0.0 110.432 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.39 -38.87 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.619 1.168 . . . . 0.0 111.051 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -59.68 -40.19 87.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.502 0.721 . . . . 0.0 112.174 171.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -71.72 -24.76 61.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.454 1.102 . . . . 0.0 113.618 174.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 23.1 t -68.93 -62.22 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.727 1.149 . . . . 0.0 110.615 169.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.1 p -64.66 -33.64 76.43 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.81 0.844 . . . . 0.0 112.659 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.76 -28.67 68.9 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.827 0.851 . . . . 0.0 112.873 172.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.79 -23.16 68.92 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.333 0.968 . . . . 0.0 114.163 174.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -114.18 12.07 17.68 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.94 1.696 . . . . 0.0 113.296 172.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.0 m 54.88 27.68 9.39 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.982 1.713 . . . . 0.0 114.479 -175.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.4 mt -76.81 127.49 32.85 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.133 1.373 . . . . 0.0 110.57 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.52 164.17 25.64 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.686 1.194 . . . . 0.0 113.462 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 53.64 68.23 0.88 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.313 1.845 . . . . 0.0 113.64 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -60.73 -21.95 63.49 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.072 -1.017 . . . . 0.0 113.496 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -54.98 -28.32 50.81 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 112.923 171.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -77.3 -18.33 57.6 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.399 1.08 . . . . 0.0 113.027 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -98.07 158.74 15.37 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -168.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.03 154.51 42.59 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.702 2.401 . . . . 0.0 110.061 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -87.3 150.49 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.42 0.629 . . . . 0.0 109.851 168.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -137.14 143.44 42.47 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.411 1.884 . . . . 0.0 109.181 -176.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 . . . . . 0 N--CA 1.471 0.6 0 C-N-CA 123.225 0.61 . . . . 0.0 110.543 171.734 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 mm -76.32 135.65 26.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.664 0.745 . . . . 0.0 110.797 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.4 p -143.3 173.7 11.37 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.586 2.355 . . . . 0.0 109.136 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -57.08 -22.53 40.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -90.0 -52.89 4.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.436 . . . . 0.0 112.161 169.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.7 -17.04 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -171.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.31 -28.08 40.0 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.521 1.128 . . . . 0.0 113.665 169.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -72.48 -15.93 61.8 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.203 1.001 . . . . 0.0 113.442 177.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.83 -14.14 59.42 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.902 0.881 . . . . 0.0 112.945 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.3 mt -74.8 134.0 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 124.556 1.143 . . . . 0.0 110.016 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 168.02 14.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.713 2.005 . . . . 0.0 112.28 174.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.76 123.76 18.43 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.69 -0.631 . . . . 0.0 111.176 174.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.53 34.15 36.57 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.1 0.857 . . . . 0.0 114.084 -172.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.0 m -79.06 132.45 36.62 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.168 1.484 . . . . 0.0 110.716 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mt -86.44 113.21 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.6 mt -109.0 177.18 4.84 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.123 1.769 . . . . 0.0 110.869 176.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.6 ttt85 -145.64 137.93 25.6 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.56 1.944 . . . . 0.0 110.294 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 tp -82.69 136.98 34.59 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.557 0.743 . . . . 0.0 110.06 171.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.8 t -156.84 152.32 26.7 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.049 0.94 . . . . 0.0 110.834 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.7 p -72.14 135.29 46.14 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.714 -1.241 . . . . 0.0 110.976 172.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 CA--C 1.54 0.592 0 C-N-CA 125.322 1.449 . . . . 0.0 113.554 -170.541 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.3 mt . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 120.541 0.21 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.0 m -133.41 132.46 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.701 1.6 . . . . 0.0 112.068 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -75.74 138.43 41.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.305 1.042 . . . . 0.0 111.306 175.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m -139.92 157.56 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.351 1.461 . . . . 0.0 111.949 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -111.8 143.58 42.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.811 1.244 . . . . 0.0 109.708 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.6 mt -130.07 125.1 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.761 0.824 . . . . 0.0 110.622 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -86.63 144.81 26.99 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.587 1.555 . . . . 0.0 112.898 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -154.72 142.8 14.27 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 125.815 1.646 . . . . 0.0 110.415 169.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.34 140.28 75.98 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.733 2.288 . . . . 0.0 113.51 -174.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.77 14.08 69.74 Favored Glycine 0 CA--C 1.539 1.534 0 N-CA-C 115.31 0.884 . . . . 0.0 115.31 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.45 156.62 48.36 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.274 1.429 . . . . 0.0 112.805 -177.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -69.08 150.96 97.37 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.918 0.887 . . . . 0.0 111.396 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.17 125.88 18.08 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.792 2.328 . . . . 0.0 111.914 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -83.65 114.83 21.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.89 0.876 . . . . 0.0 110.523 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.6 mt -81.81 134.49 35.43 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.859 0.864 . . . . 0.0 109.815 169.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ppp? -158.36 178.98 9.57 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.575 1.15 . . . . 0.0 111.607 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -124.88 119.75 29.7 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.414 1.086 . . . . 0.0 111.309 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.1 mt -86.11 114.01 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 125.115 1.366 . . . . 0.0 109.085 174.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -88.8 117.24 27.64 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.004 0.922 . . . . 0.0 109.108 168.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -66.43 -14.47 62.22 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -88.12 -17.38 31.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.944 1.297 . . . . 0.0 113.906 172.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -79.32 147.01 67.82 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-N 119.628 1.103 . . . . 0.0 111.462 172.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.35 141.48 51.62 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.823 2.349 . . . . 0.0 111.086 175.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.96 -30.71 70.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.944 -0.551 . . . . 0.0 112.212 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m -59.92 -43.56 94.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.187 0.903 . . . . 0.0 112.734 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -39.32 79.71 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.793 -0.567 . . . . 0.0 111.975 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 83.8 mt -63.63 -48.45 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.503 0.721 . . . . 0.0 110.438 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.1 mt -61.58 -38.49 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.334 1.053 . . . . 0.0 110.768 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.06 -42.6 90.71 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 119.066 0.848 . . . . 0.0 112.146 170.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -69.01 -30.07 68.38 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.364 1.066 . . . . 0.0 112.974 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.49 -53.51 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 121.46 -0.775 . . . . 0.0 110.612 169.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -60.83 -43.49 98.19 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.776 0.83 . . . . 0.0 112.072 -176.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.88 -29.93 69.85 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.074 0.949 . . . . 0.0 112.891 175.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.99 -23.93 64.29 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.365 0.984 . . . . 0.0 114.295 174.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.4 m0 -115.57 14.21 16.51 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.907 1.683 . . . . 0.0 113.234 172.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.85 28.09 11.93 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.056 1.742 . . . . 0.0 114.346 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.1 mt -74.25 122.99 23.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.029 1.331 . . . . 0.0 111.283 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.56 164.56 26.44 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.489 1.116 . . . . 0.0 112.336 172.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.2 m120 54.85 50.58 15.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.243 1.417 . . . . 0.0 113.59 173.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -57.42 -20.69 31.73 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.151 0.98 . . . . 0.0 113.385 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -54.99 -28.83 54.97 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.229 1.412 . . . . 0.0 113.072 171.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -78.9 -16.45 57.01 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.222 1.009 . . . . 0.0 112.989 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -92.78 159.26 15.48 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.76 148.87 34.63 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.089 2.156 . . . . 0.0 110.202 171.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.0 mt -81.5 153.19 26.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.462 0.648 . . . . 0.0 109.586 167.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -150.56 150.28 31.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.495 . . . . 0.0 109.331 -170.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 . . . . . 0 N--CA 1.474 0.771 0 O-C-N 120.945 -1.097 . . . . 0.0 112.082 178.03 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.467 0.416 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.3 mm -80.08 131.03 35.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.652 0.739 . . . . 0.0 110.711 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 45.5 p -148.39 171.76 15.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.214 2.206 . . . . 0.0 109.321 -173.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.79 -21.54 60.96 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.905 -1.122 . . . . 0.0 113.288 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -84.02 -28.07 27.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.472 1.509 . . . . 0.0 113.564 173.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -109.53 -21.25 12.55 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -170.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.07 -25.15 65.16 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -173.116 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -62.66 -22.4 66.42 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.693 1.197 . . . . 0.0 113.298 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -74.48 -14.66 60.85 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.913 0.885 . . . . 0.0 113.033 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 69.7 mt -73.26 132.74 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.475 1.11 . . . . 0.0 109.876 174.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -125.8 169.78 12.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.28 1.832 . . . . 0.0 112.283 174.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -58.99 128.22 36.12 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.742 -0.599 . . . . 0.0 111.08 173.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.88 8.76 78.88 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.93 1.252 . . . . 0.0 115.417 -175.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.9 m -64.83 133.57 52.21 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 119.643 1.722 . . . . 0.0 111.179 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.3 mt -95.32 121.33 45.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.576 0.75 . . . . 0.0 109.194 170.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.5 mt -113.25 175.2 5.55 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.846 2.058 . . . . 0.0 110.555 177.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -139.07 148.7 43.68 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.295 1.838 . . . . 0.0 110.257 169.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.7 tp -89.68 139.53 30.47 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.47 1.108 . . . . 0.0 110.327 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.66 154.41 28.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.206 1.002 . . . . 0.0 110.823 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 29.1 p -73.16 136.7 44.82 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.768 -1.208 . . . . 0.0 110.76 169.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 CA--C 1.538 0.489 0 C-N-CA 125.057 1.343 . . . . 0.0 112.167 -174.842 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mt . . . . . 0 N--CA 1.471 0.593 0 CA-C-O 120.717 0.294 . . . . 0.0 111.452 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.61 131.59 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.622 1.569 . . . . 0.0 112.272 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -79.08 137.81 37.68 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.734 1.214 . . . . 0.0 110.886 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.43 160.17 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.89 1.676 . . . . 0.0 112.341 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.41 116.95 26.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.261 . . . . 0.0 110.356 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.2 mt -105.1 126.49 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.911 0.885 . . . . 0.0 111.007 -171.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -84.02 142.31 30.56 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.848 1.659 . . . . 0.0 112.849 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -155.27 142.58 13.81 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 125.918 1.687 . . . . 0.0 110.424 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.21 145.53 93.41 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.708 2.272 . . . . 0.0 114.008 -175.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.14 12.25 71.73 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.508 0.963 . . . . 0.0 115.508 177.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.5 158.08 43.93 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.279 1.431 . . . . 0.0 112.536 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -70.06 155.21 93.83 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 123.84 0.856 . . . . 0.0 111.52 169.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -59.48 130.0 33.66 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.814 2.342 . . . . 0.0 112.698 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -80.19 106.71 12.4 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.024 0.93 . . . . 0.0 109.982 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 60.4 mt -76.05 125.16 28.61 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.625 0.77 . . . . 0.0 109.401 169.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -153.95 178.26 10.12 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -114.91 125.75 54.0 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.154 0.982 . . . . 0.0 111.152 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.3 mt -88.43 108.58 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 170.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -80.87 114.21 19.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.095 0.558 . . . . 0.0 109.774 169.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -68.29 -11.24 59.11 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -76.81 -34.65 57.91 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.373 0.988 . . . . 0.0 112.802 169.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -76.97 145.13 73.36 Favored Pre-proline 0 N--CA 1.481 1.075 0 C-N-CA 125.283 1.433 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.86 142.87 64.54 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.046 2.497 . . . . 0.0 111.17 175.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -59.1 -32.94 70.27 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-O 118.545 -0.74 . . . . 0.0 112.29 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.41 -41.52 85.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.64 1.109 . . . . 0.0 112.563 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.97 72.69 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.072 0.549 . . . . 0.0 112.254 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.67 -46.73 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.195 0.598 . . . . 0.0 110.332 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.4 mt -60.42 -38.57 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 125.043 1.337 . . . . 0.0 110.935 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -57.05 -46.92 82.07 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.246 0.93 . . . . 0.0 111.565 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -67.22 -28.57 68.18 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.509 1.124 . . . . 0.0 113.324 177.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.79 -52.33 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.523 1.056 . . . . 0.0 110.023 169.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.5 m -61.8 -44.27 97.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.901 0.881 . . . . 0.0 111.793 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -59.11 -29.21 67.21 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.12 1.368 . . . . 0.0 112.905 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.07 -23.47 66.02 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.401 1.0 . . . . 0.0 114.469 173.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -117.33 13.7 14.59 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.032 1.733 . . . . 0.0 113.23 172.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t 55.52 28.53 11.89 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.115 1.766 . . . . 0.0 114.351 -176.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.5 mt -74.21 125.29 28.07 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.314 1.446 . . . . 0.0 111.458 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.68 163.61 27.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.53 1.132 . . . . 0.0 112.516 174.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 54.25 53.29 11.17 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.637 1.575 . . . . 0.0 113.89 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 -58.26 -18.11 24.22 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.171 0.988 . . . . 0.0 113.562 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -55.84 -28.84 58.34 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.986 1.315 . . . . 0.0 113.008 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -79.68 -15.84 56.83 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.03 0.932 . . . . 0.0 112.771 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -94.43 159.27 15.18 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.625 1.202 . . . . 0.0 114.11 -169.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.32 151.24 36.26 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.396 2.278 . . . . 0.0 110.105 173.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.0 mt -82.33 156.64 24.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 166.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -148.87 150.08 32.37 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.649 1.18 . . . . 0.0 110.496 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 . . . . . 0 N--CA 1.472 0.655 0 O-C-N 121.608 -0.682 . . . . 0.0 112.795 173.601 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 120.911 0.386 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 41.6 mm -81.51 134.21 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.228 1.011 . . . . 0.0 110.307 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -143.95 168.9 18.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.271 1.828 . . . . 0.0 109.661 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.21 -13.5 28.38 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.685 -1.259 . . . . 0.0 113.213 174.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -99.07 -6.75 27.86 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.633 1.973 . . . . 0.0 114.282 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.58 -15.97 4.39 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.094 1.358 . . . . 0.0 113.969 -173.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.95 -19.53 62.84 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -62.31 -22.51 66.11 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.843 1.257 . . . . 0.0 112.838 173.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -75.56 -13.45 60.35 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.108 0.963 . . . . 0.0 113.253 176.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.92 131.26 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.184 0.994 . . . . 0.0 109.603 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -124.61 169.85 11.52 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.912 1.685 . . . . 0.0 111.791 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -57.13 126.1 25.68 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 111.278 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.22 11.06 76.63 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.075 1.322 . . . . 0.0 115.445 -176.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.3 m -67.26 128.8 37.75 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.626 1.713 . . . . 0.0 111.405 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -83.36 126.23 40.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 169.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.7 mt -121.47 175.56 6.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.678 1.991 . . . . 0.0 110.867 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 73.8 ttt-85 -137.53 133.53 34.63 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 127.364 2.266 . . . . 0.0 110.033 176.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.5 tp -81.86 137.48 35.23 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 167.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.0 t -157.08 152.76 26.84 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.134 0.574 . . . . 0.0 111.239 -175.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.1 p -70.62 138.94 51.22 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.131 -0.981 . . . . 0.0 109.304 167.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.543 0.707 0 C-N-CA 126.022 1.729 . . . . 0.0 112.003 -178.834 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.9 mt . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 m -134.36 132.45 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.349 1.46 . . . . 0.0 111.489 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -77.16 144.09 38.62 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.53 155.19 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 125.922 1.689 . . . . 0.0 111.391 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.9 112.95 21.02 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.563 1.145 . . . . 0.0 110.331 175.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.2 mt -102.52 126.4 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.909 0.884 . . . . 0.0 111.075 -169.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -82.24 146.87 29.26 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.14 1.776 . . . . 0.0 113.215 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -154.25 141.39 13.45 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 125.854 1.662 . . . . 0.0 110.232 168.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.54 138.1 73.58 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.664 2.243 . . . . 0.0 113.463 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.07 12.77 72.15 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.309 0.883 . . . . 0.0 115.309 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.85 152.96 50.85 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.222 1.409 . . . . 0.0 112.641 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -68.99 150.67 97.54 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 123.898 0.879 . . . . 0.0 111.072 170.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.37 129.68 30.78 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.471 2.114 . . . . 0.0 113.179 -179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -80.57 110.75 16.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.608 1.163 . . . . 0.0 110.36 176.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.3 mt -77.33 126.54 31.09 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.487 0.715 . . . . 0.0 109.818 169.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.0 ptm -155.02 177.46 11.3 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.291 1.036 . . . . 0.0 111.555 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -112.74 136.07 52.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.962 0.905 . . . . 0.0 112.6 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.8 mt -96.78 109.49 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 125.563 1.545 . . . . 0.0 107.914 169.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -84.56 116.84 23.36 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -66.98 -11.78 57.86 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -86.62 -22.54 26.13 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.747 1.219 . . . . 0.0 113.63 170.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -82.12 142.82 48.14 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.324 1.05 . . . . 0.0 111.57 175.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.57 144.9 68.39 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.403 2.736 . . . . 0.0 111.621 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.5 mt -60.33 -32.67 71.46 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.084 176.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 m -58.85 -42.9 90.43 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.418 1.008 . . . . 0.0 112.583 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.56 -39.4 77.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.067 0.547 . . . . 0.0 111.981 174.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.46 -46.35 95.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.523 0.729 . . . . 0.0 110.687 176.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.8 mt -60.84 -38.24 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.93 1.292 . . . . 0.0 111.281 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.04 -38.7 89.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.4 0.68 . . . . 0.0 112.251 171.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.34 -24.74 62.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.235 1.014 . . . . 0.0 113.195 173.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.6 t -69.87 -58.04 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 119.604 1.093 . . . . 0.0 110.704 169.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 15.3 p -63.74 -33.52 75.83 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.502 0.721 . . . . 0.0 112.654 -169.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -61.43 -26.98 68.23 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.58 1.152 . . . . 0.0 113.045 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.36 -22.86 71.48 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.279 0.942 . . . . 0.0 114.225 174.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -119.03 11.81 12.56 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.985 1.714 . . . . 0.0 113.27 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 m 54.5 29.92 12.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.025 1.73 . . . . 0.0 114.376 -175.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.9 mt -77.6 127.03 31.8 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.542 1.137 . . . . 0.0 110.445 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.18 160.6 27.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.522 1.129 . . . . 0.0 113.445 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 51.55 69.11 0.7 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.774 2.03 . . . . 0.0 113.261 170.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -60.56 -18.83 55.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.546 1.138 . . . . 0.0 113.72 -176.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -54.75 -28.28 47.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.227 1.411 . . . . 0.0 112.933 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -78.29 -17.93 55.95 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.859 0.863 . . . . 0.0 113.204 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -99.21 158.58 15.59 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -168.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.79 149.83 33.09 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.597 1.959 . . . . 0.0 110.256 171.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.4 mt -76.56 154.67 34.28 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.445 0.64 . . . . 0.0 109.43 167.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -148.58 156.58 42.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.279 1.831 . . . . 0.0 108.808 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 . . . . . 0 N--CA 1.473 0.722 0 O-C-N 120.74 -1.225 . . . . 0.0 111.984 170.822 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 . . . . . 0 CA--C 1.537 0.472 0 CA-C-O 121.311 0.577 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.4 mm -80.71 134.35 27.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 123.942 0.897 . . . . 0.0 110.586 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -131.78 163.1 28.95 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.38 1.872 . . . . 0.0 111.029 -176.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -61.7 -16.24 47.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -86.04 -52.68 5.54 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.938 1.295 . . . . 0.0 112.693 169.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -86.67 -12.24 48.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -169.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.8 ptm180 -54.64 -23.42 17.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.972 1.309 . . . . 0.0 114.269 173.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -65.35 -18.61 65.45 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.11 1.364 . . . . 0.0 113.363 175.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -80.59 -12.68 59.48 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 113.533 173.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -71.0 134.26 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.902 0.881 . . . . 0.0 109.776 175.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -121.38 165.26 15.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.501 1.52 . . . . 0.0 112.219 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -60.53 123.16 16.55 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.001 0.52 . . . . 0.0 110.985 177.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.43 11.0 63.08 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.259 1.409 . . . . 0.0 115.476 -174.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.3 m -66.15 129.71 40.73 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.729 1.765 . . . . 0.0 110.973 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.2 mt -85.11 125.18 40.39 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.7 mt -119.06 -179.42 3.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.682 1.993 . . . . 0.0 110.714 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.5 ttp-105 -145.89 135.47 23.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 127.637 2.375 . . . . 0.0 110.09 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.5 tp -84.45 138.25 32.92 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.592 0.757 . . . . 0.0 109.827 169.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.2 t -160.15 155.55 25.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.996 0.918 . . . . 0.0 110.369 -177.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.0 p -70.33 148.82 48.02 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.743 -1.223 . . . . 0.0 111.183 170.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.5 p . . . . . 0 CA--C 1.546 0.822 0 C-N-CA 124.77 1.228 . . . . 0.0 113.916 -171.955 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.9 mt . . . . . 0 N--CA 1.472 0.665 0 CA-C-O 120.591 0.234 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.3 m -133.11 135.05 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.636 1.574 . . . . 0.0 111.928 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -76.11 142.52 41.66 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.078 0.951 . . . . 0.0 111.676 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.7 m -142.34 157.31 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.563 1.545 . . . . 0.0 111.889 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.06 123.09 43.62 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.869 1.268 . . . . 0.0 110.029 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -111.09 126.09 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.02 0.928 . . . . 0.0 110.836 -170.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -83.54 142.23 31.03 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.033 1.733 . . . . 0.0 112.733 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -155.06 142.72 14.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.89 1.676 . . . . 0.0 110.535 170.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.32 142.98 88.03 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.681 2.254 . . . . 0.0 113.78 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.05 13.83 70.23 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 177.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.0 157.45 45.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.198 1.399 . . . . 0.0 112.645 -176.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -69.05 152.46 96.77 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.826 0.85 . . . . 0.0 111.411 170.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -60.33 128.4 26.07 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.737 2.291 . . . . 0.0 112.36 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -81.25 111.22 17.46 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.939 0.895 . . . . 0.0 110.283 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -78.32 128.69 34.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.579 0.752 . . . . 0.0 109.592 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.1 ptm -154.99 178.59 10.02 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.706 0.802 . . . . 0.0 112.418 174.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 -112.08 129.74 56.12 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.791 1.237 . . . . 0.0 111.481 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.9 mt -97.76 111.76 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 125.259 1.424 . . . . 0.0 108.362 170.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -85.95 117.36 24.75 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.966 -0.754 . . . . 0.0 108.966 169.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -66.24 -14.76 62.45 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -80.78 -30.81 35.96 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.139 1.375 . . . . 0.0 113.664 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -73.55 143.22 82.0 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 124.188 0.995 . . . . 0.0 111.377 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.85 142.39 62.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.015 2.477 . . . . 0.0 111.108 177.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -59.36 -32.43 70.11 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.539 -0.744 . . . . 0.0 112.173 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m -58.51 -41.86 86.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.624 1.102 . . . . 0.0 112.76 176.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.78 -40.9 72.31 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.064 0.546 . . . . 0.0 112.127 175.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.61 -46.09 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.399 0.68 . . . . 0.0 110.533 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.36 -37.34 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.826 1.251 . . . . 0.0 110.969 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -61.26 -41.94 97.78 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.477 1.035 . . . . 0.0 112.243 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -66.84 -28.51 68.41 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.392 1.077 . . . . 0.0 112.959 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.0 -54.29 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.374 0.988 . . . . 0.0 110.177 168.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -61.22 -41.77 97.44 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.222 1.009 . . . . 0.0 112.137 -174.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.05 -29.85 68.8 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.142 0.977 . . . . 0.0 112.925 175.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.91 -23.35 65.59 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.348 0.975 . . . . 0.0 114.403 174.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -117.54 14.41 14.53 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.982 1.713 . . . . 0.0 113.177 172.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.67 28.58 12.28 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.099 1.76 . . . . 0.0 114.337 -177.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.6 mt -74.79 127.36 32.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.17 1.388 . . . . 0.0 111.622 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.63 165.51 24.18 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.689 1.196 . . . . 0.0 112.461 173.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 53.96 54.77 9.24 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.558 1.543 . . . . 0.0 113.629 173.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -58.31 -21.2 48.31 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.928 0.891 . . . . 0.0 112.987 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -56.61 -28.14 59.75 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.548 1.539 . . . . 0.0 112.827 175.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -80.63 -17.5 51.08 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.967 0.907 . . . . 0.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -90.77 159.9 16.07 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.539 1.162 . . . . 0.0 113.869 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.24 151.27 37.31 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.789 2.436 . . . . 0.0 109.828 172.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.7 mt -82.92 158.61 22.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 166.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -149.4 145.64 27.06 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 124.648 1.179 . . . . 0.0 110.494 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.0 m-70 . . . . . 0 N--CA 1.473 0.712 0 O-C-N 121.67 -0.644 . . . . 0.0 110.996 171.946 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 . . . . . 0 CA--C 1.541 0.603 0 CA-C-O 120.758 0.313 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mm -83.82 133.86 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.77 1.228 . . . . 0.0 110.549 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.3 p -144.55 165.73 27.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 127.005 2.122 . . . . 0.0 110.178 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.19 -11.91 17.13 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 121.041 -1.037 . . . . 0.0 113.344 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -90.46 -20.96 22.13 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.765 1.626 . . . . 0.0 114.585 176.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -135.51 -2.41 2.45 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -173.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.49 -22.16 12.08 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 175.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -62.59 -18.49 62.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.172 1.389 . . . . 0.0 113.415 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -73.38 -14.72 61.33 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.5 mt -72.87 128.82 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.92 0.888 . . . . 0.0 109.601 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -120.13 174.56 6.41 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.112 1.765 . . . . 0.0 112.246 172.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -57.52 130.46 46.42 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.907 -0.495 . . . . 0.0 111.24 170.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.56 10.93 83.77 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 124.71 1.148 . . . . 0.0 115.367 -177.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 90.3 m -65.67 129.65 40.5 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.618 1.709 . . . . 0.0 110.967 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 35.1 mt -86.28 122.07 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 170.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.3 mt -118.57 174.66 6.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.155 1.782 . . . . 0.0 111.082 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.2 ttt-85 -138.57 135.07 34.63 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 127.338 2.255 . . . . 0.0 109.851 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -83.24 136.66 34.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.048 0.539 . . . . 0.0 109.651 168.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.1 t -158.26 149.26 20.78 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.776 0.83 . . . . 0.0 110.82 -174.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.6 p -71.54 132.97 45.45 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.655 -1.278 . . . . 0.0 110.627 170.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 CA--C 1.539 0.548 0 C-N-CA 125.125 1.37 . . . . 0.0 112.196 -176.056 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.1 mt . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.7 m -133.2 131.71 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.23 1.412 . . . . 0.0 111.945 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -77.46 138.58 39.33 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.957 0.903 . . . . 0.0 111.168 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -137.47 157.07 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.7 1.6 . . . . 0.0 111.62 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.91 132.4 55.33 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.266 1.026 . . . . 0.0 109.886 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.0 mt -121.28 123.55 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.042 0.937 . . . . 0.0 110.628 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -82.46 143.85 30.86 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.151 1.381 . . . . 0.0 112.899 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -156.09 143.8 14.07 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.915 1.686 . . . . 0.0 110.161 169.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -62.77 144.98 94.71 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.665 2.243 . . . . 0.0 113.918 -175.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.0 11.48 74.46 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.82 155.66 44.21 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.192 1.397 . . . . 0.0 112.585 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -70.09 152.53 95.77 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 123.507 0.723 . . . . 0.0 110.955 169.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -59.21 130.76 37.59 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.45 2.1 . . . . 0.0 113.408 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -78.47 118.09 20.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.726 1.21 . . . . 0.0 110.488 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.1 131.48 35.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.292 0.637 . . . . 0.0 109.404 168.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.8 ptm -155.73 176.71 12.26 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.145 0.978 . . . . 0.0 111.644 172.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -115.31 129.82 56.72 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.149 0.98 . . . . 0.0 111.745 176.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.8 mt -95.44 112.36 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 125.8 1.64 . . . . 0.0 108.504 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -86.32 116.99 24.84 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.353 1.061 . . . . 0.0 109.966 171.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -68.2 -13.36 62.18 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -78.76 -31.03 46.02 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.338 0.972 . . . . 0.0 113.184 169.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -77.03 144.88 72.73 Favored Pre-proline 0 N--CA 1.48 1.034 0 C-N-CA 123.984 0.914 . . . . 0.0 112.042 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.2 143.26 70.43 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.124 2.55 . . . . 0.0 111.214 175.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.34 -30.28 69.43 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.117 -0.944 . . . . 0.0 112.672 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.1 t -57.97 -47.14 83.84 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.246 1.385 . . . . 0.0 112.097 173.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.62 -40.34 95.32 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.63 -0.669 . . . . 0.0 112.13 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 94.3 mt -67.1 -45.93 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.672 0.789 . . . . 0.0 110.815 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.8 mt -61.36 -35.82 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.646 1.179 . . . . 0.0 110.645 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 tttp -62.55 -41.16 98.72 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.12 0.873 . . . . 0.0 112.394 171.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -65.37 -30.44 71.27 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.234 1.014 . . . . 0.0 113.101 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.59 -54.52 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 119.375 0.989 . . . . 0.0 110.247 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.3 m -61.36 -42.47 98.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.444 1.098 . . . . 0.0 112.089 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -60.2 -29.53 68.78 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.11 0.964 . . . . 0.0 112.859 175.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.61 -23.37 64.97 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.49 1.043 . . . . 0.0 114.364 174.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.57 16.09 14.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.939 1.696 . . . . 0.0 113.14 172.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.9 p 56.19 21.21 5.06 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.241 2.217 . . . . 0.0 115.505 -176.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.35 126.86 30.94 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.428 1.491 . . . . 0.0 111.649 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.87 164.33 24.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.697 1.199 . . . . 0.0 112.388 173.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 52.98 62.01 2.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.74 1.616 . . . . 0.0 113.464 173.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -61.17 -19.19 61.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.807 0.843 . . . . 0.0 112.808 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -53.25 -30.14 36.57 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.005 1.722 . . . . 0.0 113.198 170.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -76.69 -14.84 59.92 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.142 0.977 . . . . 0.0 113.046 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -102.38 158.55 16.12 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.886 1.275 . . . . 0.0 114.247 -168.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.77 150.97 39.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.258 2.223 . . . . 0.0 109.852 169.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.93 154.58 26.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 166.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -145.11 143.71 30.53 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.516 1.126 . . . . 0.0 109.896 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.7 m-70 . . . . . 0 N--CA 1.473 0.724 0 O-C-N 121.659 -0.651 . . . . 0.0 111.699 174.01 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 121.103 0.477 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -80.99 137.53 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.1 0.96 . . . . 0.0 110.109 174.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 15.5 p -144.28 168.43 20.07 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.507 1.923 . . . . 0.0 109.447 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -63.78 -4.19 2.97 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 177.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -118.89 -15.61 9.34 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.389 1.476 . . . . 0.0 114.662 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -90.12 -22.71 21.64 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.86 1.209 . . . . 0.0 113.633 173.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -59.4 -19.82 50.16 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -173.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -63.64 -24.61 67.86 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.332 1.053 . . . . 0.0 113.056 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -74.83 -16.08 60.71 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.834 0.854 . . . . 0.0 113.097 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.6 mt -71.06 133.33 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.102 0.961 . . . . 0.0 109.841 173.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -129.7 171.37 12.72 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.364 1.865 . . . . 0.0 111.328 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -60.24 121.32 11.66 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.911 -0.493 . . . . 0.0 110.312 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.16 8.56 81.61 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.849 1.214 . . . . 0.0 115.459 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.3 m -63.38 130.72 45.64 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.893 1.847 . . . . 0.0 110.564 173.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mt -91.65 123.61 43.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 123.351 0.66 . . . . 0.0 109.425 173.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -114.96 174.27 6.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.556 1.942 . . . . 0.0 110.943 177.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -137.49 136.05 37.36 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 127.082 2.153 . . . . 0.0 109.745 173.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.0 tp -79.47 136.72 37.0 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.25 0.62 . . . . 0.0 110.009 169.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.6 t -155.07 147.53 24.07 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.564 0.746 . . . . 0.0 111.036 -176.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -71.23 130.62 41.89 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.879 -1.138 . . . . 0.0 110.532 171.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.7 p . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 125.231 1.412 . . . . 0.0 114.371 -168.407 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 mt . . . . . 0 N--CA 1.471 0.58 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -134.37 133.33 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.434 1.494 . . . . 0.0 111.883 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -75.05 142.15 43.78 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.121 0.969 . . . . 0.0 110.767 174.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m -141.55 156.77 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.807 1.643 . . . . 0.0 111.223 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.75 124.77 50.44 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.376 1.07 . . . . 0.0 110.269 171.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mt -112.46 123.76 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.334 1.054 . . . . 0.0 110.761 -170.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -79.55 144.34 34.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 112.817 174.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -154.65 143.29 14.65 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.777 1.631 . . . . 0.0 110.359 169.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -63.88 142.1 80.73 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.592 2.195 . . . . 0.0 113.6 -173.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.52 70.94 Favored Glycine 0 CA--C 1.539 1.533 0 N-CA-C 115.378 0.911 . . . . 0.0 115.378 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.16 154.91 46.1 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.259 1.424 . . . . 0.0 112.558 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -70.15 151.71 95.91 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 123.692 0.797 . . . . 0.0 111.177 169.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -59.43 130.64 36.6 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.502 2.135 . . . . 0.0 113.377 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -80.22 117.9 21.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.544 1.137 . . . . 0.0 110.637 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt -79.73 130.84 35.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 168.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.5 ptm -154.57 179.51 8.97 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.296 1.038 . . . . 0.0 111.226 171.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -122.25 125.74 46.7 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.137 0.975 . . . . 0.0 111.753 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.4 mt -89.78 116.74 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 C-N-CA 125.638 1.575 . . . . 0.0 108.932 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -89.9 113.25 24.83 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.088 1.355 . . . . 0.0 109.715 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -69.61 -11.7 61.05 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -88.97 -15.99 32.84 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.51 1.124 . . . . 0.0 113.79 170.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -79.06 149.04 72.73 Favored Pre-proline 0 N--CA 1.481 1.103 0 CA-C-N 119.831 1.196 . . . . 0.0 112.203 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.48 146.25 84.64 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.899 2.4 . . . . 0.0 110.984 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 mt -63.49 -27.94 69.62 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 118.529 -0.748 . . . . 0.0 112.264 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.5 t -59.0 -45.99 89.29 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.663 1.119 . . . . 0.0 112.423 171.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.48 99.25 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.584 -0.697 . . . . 0.0 112.078 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 53.3 mt -65.18 -49.02 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.595 0.758 . . . . 0.0 110.877 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.7 mt -61.74 -36.31 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.122 0.969 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.31 -43.62 92.63 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.114 0.87 . . . . 0.0 112.21 170.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -66.94 -27.53 67.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.362 1.065 . . . . 0.0 113.079 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 16.0 t -68.37 -57.48 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 CA-C-N 119.576 1.08 . . . . 0.0 110.358 169.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.6 m -60.98 -40.86 95.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.259 1.024 . . . . 0.0 112.522 -173.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -61.12 -27.66 68.54 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.45 -23.68 68.71 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.391 0.996 . . . . 0.0 114.413 174.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -116.27 16.03 15.85 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.802 1.641 . . . . 0.0 113.146 172.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 m 55.22 26.6 8.62 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.977 1.711 . . . . 0.0 114.557 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.2 mt -73.57 125.33 27.73 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.079 1.352 . . . . 0.0 111.164 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.6 155.7 37.55 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.404 1.081 . . . . 0.0 112.507 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 49.46 71.6 0.37 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.62 1.968 . . . . 0.0 113.144 173.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 -60.85 -16.99 47.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.472 1.109 . . . . 0.0 112.944 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -52.07 -29.36 21.07 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.155 1.782 . . . . 0.0 113.101 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -75.51 -15.24 60.42 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.12 160.74 14.6 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -167.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.68 150.21 38.37 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.995 2.118 . . . . 0.0 110.127 169.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.05 154.48 28.11 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 166.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -147.43 147.13 29.9 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.676 1.19 . . . . 0.0 110.456 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 . . . . . 0 N--CA 1.474 0.753 0 O-C-N 121.448 -0.783 . . . . 0.0 110.945 171.792 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 . . . . . 0 CA--C 1.537 0.477 0 N-CA-C 110.453 -0.202 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 40.2 mm -78.08 132.26 32.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.884 0.874 . . . . 0.0 110.443 176.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.5 p -139.4 164.94 28.53 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 111.232 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -63.75 -6.76 6.13 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.802 1.241 . . . . 0.0 113.608 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -107.31 -8.08 16.49 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.169 1.788 . . . . 0.0 114.021 176.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -134.02 -5.28 2.74 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -55.9 -23.81 33.68 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -62.05 -21.72 65.15 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.251 1.42 . . . . 0.0 113.272 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -74.63 -14.17 60.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.012 0.925 . . . . 0.0 112.999 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.2 mt -71.55 130.61 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.046 0.938 . . . . 0.0 109.428 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -123.08 168.89 11.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.093 1.757 . . . . 0.0 112.255 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -60.86 123.41 17.46 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.768 -0.583 . . . . 0.0 110.942 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.71 11.3 64.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.268 1.413 . . . . 0.0 115.557 -174.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.2 m -65.73 131.87 47.37 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.704 1.752 . . . . 0.0 111.058 176.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mt -87.27 121.65 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -118.28 178.79 4.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.597 1.959 . . . . 0.0 110.551 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -144.44 136.32 26.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 126.759 2.023 . . . . 0.0 109.936 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.7 tp -82.77 138.15 34.12 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.131 0.572 . . . . 0.0 109.885 169.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.3 t -154.77 151.3 28.52 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.996 0.918 . . . . 0.0 110.409 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.4 p -68.9 131.81 45.7 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.89 -1.131 . . . . 0.0 110.396 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.8 t . . . . . 0 CA--C 1.543 0.702 0 C-N-CA 126.808 2.043 . . . . 0.0 112.79 -176.423 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.7 mt . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.4 m -132.51 131.87 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.988 1.315 . . . . 0.0 111.646 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.22 143.6 47.07 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.738 0.815 . . . . 0.0 110.635 172.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m -139.65 150.67 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.983 1.713 . . . . 0.0 110.988 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.37 109.54 19.23 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.558 1.143 . . . . 0.0 109.751 173.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.8 mt -99.8 124.59 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 123.848 0.859 . . . . 0.0 109.988 -173.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -93.29 149.37 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.254 1.422 . . . . 0.0 112.612 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -153.18 142.89 15.04 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.957 1.703 . . . . 0.0 110.276 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -59.99 138.9 85.01 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.698 2.265 . . . . 0.0 113.77 -175.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.85 12.8 75.08 Favored Glycine 0 CA--C 1.539 1.584 0 N-CA-C 115.436 0.934 . . . . 0.0 115.436 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.41 156.84 47.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.195 1.398 . . . . 0.0 112.912 -177.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -72.38 155.55 91.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 124.368 1.067 . . . . 0.0 111.15 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -65.89 129.26 21.61 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.554 2.169 . . . . 0.0 112.06 -177.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -79.42 106.05 11.17 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.321 1.448 . . . . 0.0 109.853 174.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.6 mt -75.38 126.89 31.92 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.338 0.655 . . . . 0.0 109.453 169.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.0 ptm -153.13 177.76 10.47 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.213 1.005 . . . . 0.0 111.462 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -117.06 129.93 56.33 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.002 0.921 . . . . 0.0 112.023 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.0 mt -92.39 109.28 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.343 1.457 . . . . 0.0 108.462 170.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -83.98 119.56 25.06 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -66.65 -11.18 52.75 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -176.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -86.76 -23.56 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.011 1.324 . . . . 0.0 113.856 171.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -78.56 141.31 60.5 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.454 1.024 . . . . 0.0 111.372 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.71 144.28 59.27 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.278 2.652 . . . . 0.0 111.628 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.71 -31.01 71.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.377 -0.82 . . . . 0.0 112.762 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -59.18 -46.83 87.39 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.874 1.215 . . . . 0.0 111.98 174.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.6 -39.64 91.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.589 -0.694 . . . . 0.0 112.329 176.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.81 -48.67 85.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.491 0.716 . . . . 0.0 110.513 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -62.7 -37.1 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.71 1.204 . . . . 0.0 110.977 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.53 -39.72 84.86 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.545 0.738 . . . . 0.0 112.038 170.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -73.26 -24.73 60.49 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.711 1.204 . . . . 0.0 113.762 173.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 32.3 t -69.31 -61.23 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.644 1.111 . . . . 0.0 110.587 169.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.8 p -64.08 -34.32 77.77 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.797 0.839 . . . . 0.0 112.624 -170.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.71 -29.24 69.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.879 0.872 . . . . 0.0 112.906 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.79 -23.54 67.4 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.406 1.003 . . . . 0.0 114.171 174.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -115.0 11.53 16.51 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.71 . . . . 0.0 113.288 172.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.65 29.34 13.48 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.088 1.755 . . . . 0.0 114.282 -176.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.0 mt -79.1 131.23 36.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.22 1.408 . . . . 0.0 110.705 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.89 164.43 22.64 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.697 1.199 . . . . 0.0 113.623 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 53.14 68.87 0.77 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.403 1.881 . . . . 0.0 113.749 170.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -62.65 -21.01 65.37 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.229 -0.92 . . . . 0.0 113.068 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -54.78 -31.01 58.25 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.737 1.615 . . . . 0.0 113.117 171.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -77.12 -21.0 54.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.791 0.837 . . . . 0.0 112.68 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.71 158.96 15.28 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 122.731 1.253 . . . . 0.0 114.002 -169.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.9 154.07 39.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.058 2.543 . . . . 0.0 109.585 174.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 34.1 mt -86.4 154.05 21.47 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 167.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -144.92 145.76 31.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.354 1.061 . . . . 0.0 110.561 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 . . . . . 0 N--CA 1.471 0.616 0 O-C-N 122.014 -0.429 . . . . 0.0 111.755 174.48 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 120.813 0.34 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.6 mm -83.6 135.05 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.847 0.859 . . . . 0.0 110.52 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.6 p -145.52 168.0 21.65 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.815 2.046 . . . . 0.0 109.119 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -62.0 -16.72 53.65 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 121.123 -0.985 . . . . 0.0 113.171 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -88.33 -34.56 17.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.664 1.586 . . . . 0.0 113.529 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -92.84 -25.43 18.11 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -57.27 -25.17 58.78 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -171.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -67.87 -15.3 63.56 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.354 1.062 . . . . 0.0 113.51 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -78.87 -16.19 57.37 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.5 mt -67.08 139.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.743 1.217 . . . . 0.0 110.09 175.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -126.79 161.63 27.74 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.405 1.482 . . . . 0.0 111.703 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -61.66 119.61 9.01 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.894 -0.504 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.47 10.71 60.29 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 125.333 1.444 . . . . 0.0 115.625 -174.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.9 m -63.66 132.44 51.09 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.615 1.707 . . . . 0.0 111.709 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.3 mt -86.62 125.33 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.566 0.747 . . . . 0.0 109.388 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -122.29 172.37 8.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.329 1.852 . . . . 0.0 111.156 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtm105 -131.09 143.73 50.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.531 1.932 . . . . 0.0 110.584 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.36 136.63 34.28 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 166.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.0 t -157.24 151.95 25.54 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.728 0.811 . . . . 0.0 111.044 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.8 p -72.23 136.66 46.43 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.674 -1.266 . . . . 0.0 110.846 171.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 CA--C 1.542 0.654 0 C-N-CA 125.516 1.527 . . . . 0.0 113.164 -173.003 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.5 mt . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -130.9 133.51 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.114 1.366 . . . . 0.0 112.209 -178.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -71.29 141.71 50.5 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.187 0.995 . . . . 0.0 111.518 171.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -141.28 153.05 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.46 1.504 . . . . 0.0 111.838 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.68 116.52 28.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.945 1.298 . . . . 0.0 109.966 173.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.9 mt -107.41 120.75 59.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.162 0.985 . . . . 0.0 110.607 -170.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -81.16 149.08 29.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.217 1.407 . . . . 0.0 112.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -152.53 142.88 15.26 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.798 1.639 . . . . 0.0 109.97 169.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -62.14 136.47 60.7 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.512 2.141 . . . . 0.0 113.416 -172.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.09 12.53 71.92 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 115.214 0.845 . . . . 0.0 115.214 -179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.41 154.32 50.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.098 1.359 . . . . 0.0 112.892 -177.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -68.83 153.8 95.56 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 124.433 1.093 . . . . 0.0 111.633 172.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -66.07 125.6 14.39 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.62 2.213 . . . . 0.0 111.68 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -77.74 110.64 12.77 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 110.415 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -75.94 127.09 32.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.294 0.638 . . . . 0.0 109.86 169.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 21.9 ptm -151.72 -178.0 6.45 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.259 1.024 . . . . 0.0 111.837 173.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -120.5 132.6 55.27 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.421 1.088 . . . . 0.0 112.117 176.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.3 mt -96.72 111.87 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.416 1.486 . . . . 0.0 108.836 171.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.69 115.44 20.95 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -67.23 -10.77 53.97 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -90.16 -22.55 21.67 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.743 1.217 . . . . 0.0 113.866 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -87.37 145.56 37.89 Favored Pre-proline 0 N--CA 1.482 1.152 0 CA-C-N 119.667 1.122 . . . . 0.0 111.336 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.36 146.42 56.4 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.272 2.648 . . . . 0.0 112.74 -173.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.88 -31.6 71.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.343 0.657 . . . . 0.0 112.533 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.3 m -60.27 -42.2 94.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.24 0.927 . . . . 0.0 112.471 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.07 78.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.194 0.598 . . . . 0.0 111.914 175.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.52 -49.05 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.288 0.635 . . . . 0.0 110.751 174.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 56.4 mt -61.35 -37.54 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.04 0.936 . . . . 0.0 111.146 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -59.33 -45.98 89.86 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.031 0.832 . . . . 0.0 111.974 170.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -68.89 -26.11 64.94 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.831 1.252 . . . . 0.0 113.094 177.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 67.1 t -68.01 -60.83 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 119.185 0.902 . . . . 0.0 109.505 168.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.2 m -58.02 -36.54 72.86 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.34 1.456 . . . . 0.0 113.381 -170.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -59.18 -27.9 66.12 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.194 0.998 . . . . 0.0 113.526 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.01 -27.28 73.24 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.326 -0.859 . . . . 0.0 114.205 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -106.48 13.81 27.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.454 1.502 . . . . 0.0 112.756 173.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.2 m 55.56 27.46 10.42 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.128 1.771 . . . . 0.0 114.211 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.2 mt -75.9 114.31 14.38 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.64 1.176 . . . . 0.0 110.909 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.75 162.0 30.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.357 1.063 . . . . 0.0 112.049 173.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 54.37 55.69 7.8 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.403 1.481 . . . . 0.0 113.332 176.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -57.76 -17.74 17.41 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 113.368 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -56.37 -28.58 59.62 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.11 1.364 . . . . 0.0 112.966 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -78.32 -14.86 59.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.158 0.983 . . . . 0.0 112.73 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -94.42 157.75 15.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.56 1.144 . . . . 0.0 114.054 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.51 145.65 31.14 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.13 2.172 . . . . 0.0 109.715 176.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -79.95 145.32 32.67 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.532 0.682 . . . . 0.0 109.593 168.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -134.06 146.85 50.71 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.371 1.869 . . . . 0.0 108.83 -176.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 . . . . . 0 N--CA 1.468 0.472 0 O-C-N 121.466 -0.771 . . . . 0.0 112.578 176.018 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.469 0.506 0 CA-C-O 120.758 0.313 . . . . 0.0 110.421 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.7 mm -75.11 130.11 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 123.438 0.695 . . . . 0.0 110.333 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.0 p -140.22 164.12 30.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.888 1.675 . . . . 0.0 110.845 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -60.6 -15.3 26.64 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.218 -0.926 . . . . 0.0 113.056 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -89.26 -15.03 34.52 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.078 1.751 . . . . 0.0 114.671 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -135.41 -7.21 2.25 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -174.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -57.16 -21.22 31.28 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -61.22 -21.58 63.98 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.914 1.286 . . . . 0.0 113.173 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.18 -13.97 60.5 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.201 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 80.4 mt -71.32 131.94 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.334 1.054 . . . . 0.0 109.778 174.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -116.23 170.37 8.58 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 112.507 171.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -58.79 128.58 37.92 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.912 -0.493 . . . . 0.0 111.013 169.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.1 9.46 76.84 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 124.961 1.267 . . . . 0.0 115.251 -176.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.7 m -64.96 130.19 42.48 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.546 1.673 . . . . 0.0 111.326 177.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.6 124.48 40.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.436 0.694 . . . . 0.0 109.321 170.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -122.38 177.79 5.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.991 2.116 . . . . 0.0 110.28 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -144.53 136.73 26.26 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.75 2.02 . . . . 0.0 110.019 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.0 tp -82.32 137.44 34.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.341 0.656 . . . . 0.0 109.999 169.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.5 t -157.26 159.45 37.62 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.168 0.987 . . . . 0.0 110.555 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.2 p -72.08 144.69 48.6 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.72 -1.238 . . . . 0.0 110.548 169.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.544 0.724 0 C-N-CA 125.729 1.612 . . . . 0.0 113.029 -174.903 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.471 0.591 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -132.08 134.29 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.656 1.583 . . . . 0.0 111.413 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.1 143.03 35.93 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.02 0.928 . . . . 0.0 110.992 174.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.93 157.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.737 1.615 . . . . 0.0 111.459 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.21 115.91 26.85 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.637 1.175 . . . . 0.0 110.033 172.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.1 mt -104.65 125.16 59.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 123.833 0.853 . . . . 0.0 110.333 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -89.16 144.34 26.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.887 1.275 . . . . 0.0 112.316 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -153.79 143.99 15.59 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.104 1.762 . . . . 0.0 110.068 173.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -62.79 145.06 94.7 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.724 2.283 . . . . 0.0 113.985 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 11.34 75.08 Favored Glycine 0 CA--C 1.539 1.552 0 N-CA-C 115.484 0.954 . . . . 0.0 115.484 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.7 156.82 44.66 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.215 1.406 . . . . 0.0 112.64 -177.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -69.55 153.77 95.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 123.767 0.827 . . . . 0.0 111.314 169.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.74 128.98 28.76 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.516 2.144 . . . . 0.0 112.907 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -81.0 112.08 18.07 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.91 1.284 . . . . 0.0 110.365 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -76.64 127.5 32.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.455 0.702 . . . . 0.0 109.62 169.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -153.89 171.6 18.72 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.171 0.988 . . . . 0.0 111.538 177.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -114.85 124.54 52.0 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.796 0.838 . . . . 0.0 112.82 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.0 mt -91.6 110.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 125.705 1.602 . . . . 0.0 108.5 174.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -85.48 117.07 24.17 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.779 0.832 . . . . 0.0 109.259 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -67.23 -13.32 61.86 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -84.26 -23.14 30.51 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.613 1.165 . . . . 0.0 113.45 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -79.94 148.03 67.38 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 124.569 1.148 . . . . 0.0 111.926 177.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.58 141.25 49.78 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.748 2.299 . . . . 0.0 111.041 175.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.38 -31.63 70.53 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.002 0.521 . . . . 0.0 112.004 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -59.82 -42.64 93.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.211 0.914 . . . . 0.0 112.804 175.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.34 79.74 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.823 -0.548 . . . . 0.0 111.99 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.57 -48.18 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.669 0.787 . . . . 0.0 110.523 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -62.68 -35.76 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 124.075 0.95 . . . . 0.0 110.757 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -60.13 -44.09 95.18 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.401 1.001 . . . . 0.0 112.28 170.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -67.48 -34.02 76.31 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.421 1.088 . . . . 0.0 112.932 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.88 -53.17 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.917 0.887 . . . . 0.0 111.119 172.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 86.6 m -59.87 -42.57 94.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.819 0.848 . . . . 0.0 112.076 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.47 -27.89 68.89 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.641 0.776 . . . . 0.0 112.971 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.8 -23.64 65.67 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.457 1.027 . . . . 0.0 114.289 172.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -115.23 16.61 16.87 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.02 1.728 . . . . 0.0 113.161 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 56.29 25.14 9.0 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 126.049 1.739 . . . . 0.0 114.732 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.4 mt -75.13 122.89 24.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.236 1.414 . . . . 0.0 111.712 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 163.36 27.66 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.145 . . . . 0.0 112.168 171.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 53.06 52.95 12.77 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.454 1.501 . . . . 0.0 113.181 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -57.73 -24.76 58.53 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.146 0.979 . . . . 0.0 112.811 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -63.48 -12.71 33.96 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.321 1.448 . . . . 0.0 113.937 173.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -81.56 -17.45 48.36 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.309 -0.87 . . . . 0.0 112.739 168.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -94.98 160.96 14.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 122.637 1.208 . . . . 0.0 113.951 -169.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.66 152.51 42.51 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.721 2.409 . . . . 0.0 109.479 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.0 mt -82.81 155.59 24.11 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -143.4 144.03 31.88 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.442 1.097 . . . . 0.0 110.614 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 176.827 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.4 mm -82.65 132.52 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.625 0.77 . . . . 0.0 110.725 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.0 p -148.9 172.3 14.91 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.244 2.217 . . . . 0.0 109.275 -174.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.58 -20.74 57.89 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.802 -1.186 . . . . 0.0 113.325 172.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.22 -18.8 23.83 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.528 1.531 . . . . 0.0 113.72 175.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -114.87 -19.27 11.06 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -174.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -61.14 -23.12 65.3 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.528 1.306 . . . . 0.0 114.528 -175.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -63.94 -22.83 67.1 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.949 1.3 . . . . 0.0 113.184 173.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -75.26 -13.6 60.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 112.864 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.1 mt -74.14 128.66 36.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.4 1.08 . . . . 0.0 109.514 172.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -113.5 173.67 6.29 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.415 1.486 . . . . 0.0 111.946 169.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -61.69 130.88 47.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.692 -0.63 . . . . 0.0 111.14 170.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.14 9.98 83.28 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 125.143 1.354 . . . . 0.0 115.646 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 88.7 m -65.95 131.74 46.96 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 119.637 1.719 . . . . 0.0 111.736 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 51.1 mt -85.34 127.73 39.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 123.574 0.75 . . . . 0.0 109.351 169.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.4 mt -124.05 171.78 9.49 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.841 2.056 . . . . 0.0 110.855 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -133.38 136.2 45.16 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 127.077 2.151 . . . . 0.0 110.229 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -82.27 137.57 34.81 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 168.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.8 t -156.76 150.09 24.25 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.776 0.83 . . . . 0.0 111.44 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.6 p -70.54 127.51 32.96 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.748 -1.22 . . . . 0.0 110.287 170.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.2 t . . . . . 0 CA--C 1.537 0.46 0 C-N-CA 125.197 1.399 . . . . 0.0 112.703 -172.466 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.9 mt . . . . . 0 N--CA 1.469 0.521 0 CA-C-O 120.765 0.317 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.9 m -134.22 131.3 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.005 1.322 . . . . 0.0 112.609 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -67.52 141.5 56.87 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.167 0.987 . . . . 0.0 110.952 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.1 m -142.03 153.55 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.797 1.239 . . . . 0.0 112.062 175.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.06 120.55 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.921 1.288 . . . . 0.0 109.602 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.0 mt -107.92 122.21 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.645 0.778 . . . . 0.0 110.593 -171.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -84.9 149.67 25.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.981 1.712 . . . . 0.0 113.187 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -156.74 142.2 12.58 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.038 1.735 . . . . 0.0 110.27 169.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -60.59 137.45 73.65 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.642 2.228 . . . . 0.0 113.506 -176.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.87 12.56 74.94 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.28 154.13 51.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.252 1.421 . . . . 0.0 112.61 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.07 152.82 92.75 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.659 0.784 . . . . 0.0 111.435 169.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -61.43 131.73 37.53 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.581 2.188 . . . . 0.0 113.063 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -82.77 109.05 16.58 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.105 0.962 . . . . 0.0 110.023 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.6 mt -74.83 132.04 41.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.41 0.684 . . . . 0.0 110.081 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ptp -154.02 179.97 8.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.218 1.007 . . . . 0.0 111.964 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -123.41 125.38 44.85 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.729 1.211 . . . . 0.0 111.338 171.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.6 mt -86.79 110.96 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 124.629 1.172 . . . . 0.0 108.891 172.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -82.99 121.59 27.2 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.152 0.981 . . . . 0.0 108.462 167.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -69.8 -10.38 58.19 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -86.38 -15.18 41.22 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.473 1.286 . . . . 0.0 114.473 169.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -87.79 140.72 31.39 Favored Pre-proline 0 N--CA 1.479 0.994 0 CA-C-N 120.071 1.305 . . . . 0.0 111.142 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 144.09 62.51 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.315 2.676 . . . . 0.0 111.443 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 mt -59.68 -33.4 71.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.94 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.57 -43.75 89.53 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.26 0.936 . . . . 0.0 112.637 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.73 -38.94 77.03 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.95 0.5 . . . . 0.0 112.147 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.87 -47.27 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.476 0.71 . . . . 0.0 110.422 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.1 mt -62.52 -36.24 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.903 1.281 . . . . 0.0 111.144 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -61.86 -39.55 92.27 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.954 0.797 . . . . 0.0 112.385 170.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -70.01 -27.09 64.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.987 0.915 . . . . 0.0 113.278 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.7 t -69.39 -57.37 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.58 1.082 . . . . 0.0 110.82 169.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.5 p -63.96 -34.41 77.91 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.499 0.72 . . . . 0.0 112.557 -169.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.99 -27.61 68.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.31 1.044 . . . . 0.0 113.064 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.53 -22.98 70.12 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.305 0.955 . . . . 0.0 114.045 174.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -120.57 13.79 11.76 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.136 1.774 . . . . 0.0 113.106 176.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.4 m 55.77 29.22 13.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.249 1.82 . . . . 0.0 114.515 -178.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.91 128.2 33.17 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.659 1.183 . . . . 0.0 110.403 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.49 165.7 20.98 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.744 1.218 . . . . 0.0 113.35 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 53.87 63.1 2.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.121 1.769 . . . . 0.0 113.746 170.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -60.39 -19.98 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -177.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -57.32 -26.23 60.59 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.24 1.416 . . . . 0.0 113.193 171.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -81.37 -19.6 42.34 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.989 0.916 . . . . 0.0 112.782 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -92.09 157.88 16.51 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.583 1.182 . . . . 0.0 113.943 -169.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.32 154.38 41.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.014 2.526 . . . . 0.0 109.736 175.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.9 mt -89.69 151.19 21.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 167.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -142.05 147.0 36.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.636 1.174 . . . . 0.0 110.137 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 . . . . . 0 N--CA 1.472 0.67 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 177.853 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 120.673 0.273 . . . . 0.0 111.305 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 35.0 mm -80.3 132.81 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.37 1.068 . . . . 0.0 110.339 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 19.5 p -140.42 163.67 32.19 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.746 1.618 . . . . 0.0 111.023 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -61.27 -12.64 14.16 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.088 -1.008 . . . . 0.0 113.197 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -94.62 -15.24 24.18 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.156 1.782 . . . . 0.0 114.472 176.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -132.93 -7.73 3.09 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -176.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.95 -22.73 16.02 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -64.87 -18.26 65.01 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.569 1.548 . . . . 0.0 113.556 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -78.98 -14.54 59.15 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.097 0.959 . . . . 0.0 113.579 176.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.51 141.79 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 124.944 1.298 . . . . 0.0 110.101 174.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -127.4 160.87 30.1 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.212 1.405 . . . . 0.0 111.723 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -60.08 124.46 20.29 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.806 -0.559 . . . . 0.0 111.326 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.08 9.04 68.11 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.168 1.366 . . . . 0.0 115.174 -174.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 96.2 m -65.03 129.06 38.33 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.581 1.69 . . . . 0.0 111.105 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.0 mt -83.46 123.19 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 169.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -116.26 176.19 5.21 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.712 2.005 . . . . 0.0 110.161 174.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 33.5 ttp85 -143.94 135.94 26.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 126.367 1.867 . . . . 0.0 110.158 177.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 tp -77.64 140.53 39.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.844 0.858 . . . . 0.0 110.604 172.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.9 t -159.27 152.41 22.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.076 0.95 . . . . 0.0 111.425 -176.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 p -75.55 134.2 40.79 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.502 -1.374 . . . . 0.0 110.69 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 40.1 t . . . . . 0 CA--C 1.544 0.728 0 C-N-CA 125.336 1.454 . . . . 0.0 113.625 -172.884 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 N--CA 1.471 0.591 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.03 131.09 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.896 1.278 . . . . 0.0 112.03 -174.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -75.5 140.85 43.05 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.068 0.947 . . . . 0.0 110.568 172.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -140.79 155.56 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.54 1.536 . . . . 0.0 111.241 -178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.53 143.94 38.51 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.24 1.016 . . . . 0.0 109.638 168.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.9 mt -131.27 123.86 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.617 0.767 . . . . 0.0 110.481 -170.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -81.77 143.23 31.95 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.336 1.454 . . . . 0.0 112.703 174.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -155.61 142.55 13.56 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.75 1.62 . . . . 0.0 110.508 169.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -63.75 142.92 85.04 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.723 2.282 . . . . 0.0 113.63 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.18 13.45 70.19 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.346 0.898 . . . . 0.0 115.346 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.27 156.58 46.41 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.262 1.425 . . . . 0.0 112.587 -177.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -70.19 153.37 95.31 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.652 0.781 . . . . 0.0 111.267 169.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.11 128.13 25.45 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.663 2.242 . . . . 0.0 112.502 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -83.33 123.36 29.56 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.814 0.846 . . . . 0.0 110.696 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 83.3 mt -85.79 135.59 33.67 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.529 0.732 . . . . 0.0 109.549 168.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -156.49 174.83 14.86 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.57 1.148 . . . . 0.0 111.486 174.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -120.2 118.34 30.24 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.245 1.018 . . . . 0.0 111.605 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.6 mt -83.69 111.28 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.241 1.417 . . . . 0.0 108.929 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -85.37 118.32 24.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.423 1.089 . . . . 0.0 109.629 169.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -68.56 -12.52 61.4 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -84.18 -23.65 30.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.515 1.126 . . . . 0.0 113.43 171.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -76.13 147.26 79.75 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 123.946 0.898 . . . . 0.0 111.929 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.84 144.14 63.83 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.974 2.45 . . . . 0.0 111.1 171.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.42 -32.08 72.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.994 -0.527 . . . . 0.0 112.173 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.6 m -58.4 -42.39 87.03 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.07 0.85 . . . . 0.0 112.555 174.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -41.61 71.93 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.897 -0.502 . . . . 0.0 111.958 175.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.09 -47.96 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.492 -0.755 . . . . 0.0 110.678 176.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.2 mt -59.82 -40.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.491 1.116 . . . . 0.0 110.671 177.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -58.99 -42.84 91.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.149 0.886 . . . . 0.0 112.514 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.59 -32.27 72.89 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.474 0.71 . . . . 0.0 112.469 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -68.57 -51.94 41.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 O-C-N 121.509 -0.744 . . . . 0.0 110.942 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 95.3 m -58.98 -44.1 91.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.785 0.834 . . . . 0.0 112.092 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -60.77 -29.38 69.39 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.218 1.007 . . . . 0.0 112.93 176.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.5 -23.52 66.87 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.241 0.924 . . . . 0.0 114.411 174.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -112.96 14.24 19.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.863 1.665 . . . . 0.0 113.261 171.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.3 m 55.33 25.96 8.13 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.914 1.686 . . . . 0.0 114.438 -175.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.82 119.49 17.12 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.813 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.47 165.03 25.88 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.388 1.075 . . . . 0.0 112.193 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.3 m120 55.23 53.87 9.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.326 1.45 . . . . 0.0 113.417 173.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -57.8 -17.57 16.67 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.244 1.018 . . . . 0.0 113.654 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -56.42 -20.46 19.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.835 1.654 . . . . 0.0 113.859 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -84.85 -15.92 43.06 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.639 1.576 . . . . 0.0 112.497 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -99.2 159.9 14.65 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.55 151.03 37.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.849 2.459 . . . . 0.0 109.81 171.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.3 mt -84.21 155.44 22.51 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 167.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -149.81 150.03 31.39 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.673 1.189 . . . . 0.0 110.044 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 . . . . . 0 N--CA 1.473 0.686 0 O-C-N 121.582 -0.698 . . . . 0.0 112.671 174.583 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 CA--C 1.54 0.565 0 CA-C-O 120.61 0.243 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.9 mm -79.7 138.12 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.546 0.738 . . . . 0.0 110.715 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.4 p -146.3 173.37 12.31 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.492 2.317 . . . . 0.0 109.223 -175.58 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -58.47 -21.27 50.93 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 174.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -90.12 -45.65 8.99 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.775 1.23 . . . . 0.0 112.599 170.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -78.11 -21.16 50.82 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.994 0.918 . . . . 0.0 113.286 -171.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -57.81 -26.17 61.6 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.205 1.002 . . . . 0.0 113.676 173.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -74.0 -17.28 61.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.695 1.198 . . . . 0.0 113.071 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -79.4 -14.42 58.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.188 0.995 . . . . 0.0 112.831 173.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.3 mt -71.33 132.01 33.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.397 1.079 . . . . 0.0 109.641 174.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -122.88 165.24 16.99 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.903 1.681 . . . . 0.0 111.568 173.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -60.12 121.8 12.81 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 121.721 -0.612 . . . . 0.0 110.944 178.011 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.66 63.92 Favored Glycine 0 CA--C 1.541 1.663 0 C-N-CA 125.302 1.429 . . . . 0.0 115.648 -174.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.5 m -63.77 134.14 54.76 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.64 1.72 . . . . 0.0 111.191 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.6 mt -91.02 121.83 41.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 121.93 0.871 . . . . 0.0 109.3 169.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.2 mt -111.85 177.6 4.59 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.337 2.255 . . . . 0.0 110.434 176.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -139.24 145.89 39.78 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.144 1.778 . . . . 0.0 110.251 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.7 tp -85.11 140.16 31.17 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.718 0.807 . . . . 0.0 109.759 170.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -155.3 150.84 27.31 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.877 0.871 . . . . 0.0 111.061 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.3 p -76.13 134.33 40.0 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.796 -1.19 . . . . 0.0 110.435 169.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.4 t . . . . . 0 CA--C 1.544 0.716 0 C-N-CA 123.676 0.79 . . . . 0.0 112.122 -175.8 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.3 mt . . . . . 0 N--CA 1.47 0.563 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.4 m -133.36 133.28 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.929 1.292 . . . . 0.0 112.091 -176.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -78.85 140.32 38.19 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.931 0.892 . . . . 0.0 111.376 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.51 157.64 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 125.82 1.648 . . . . 0.0 111.638 -177.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.16 28.49 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.622 1.169 . . . . 0.0 110.201 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.3 mt -106.22 127.29 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 124.352 1.061 . . . . 0.0 110.442 -171.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 67.5 mt-10 -89.24 149.53 23.05 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.038 1.335 . . . . 0.0 112.994 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -151.63 142.86 15.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 126.093 1.757 . . . . 0.0 110.053 170.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -60.91 137.19 70.77 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.545 2.163 . . . . 0.0 113.54 -175.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.67 12.49 74.1 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.454 0.941 . . . . 0.0 115.454 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.9 153.4 51.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.201 1.4 . . . . 0.0 112.765 -178.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -69.64 151.41 96.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.653 0.781 . . . . 0.0 111.33 170.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.1 130.32 33.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 113.321 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.16 111.79 18.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.202 1.401 . . . . 0.0 110.234 175.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.8 127.87 33.11 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.404 0.682 . . . . 0.0 109.575 169.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -155.01 177.86 10.84 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.134 0.974 . . . . 0.0 111.602 173.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -113.34 135.07 54.26 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.933 . . . . 0.0 112.202 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.2 mt -95.57 110.01 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.721 1.608 . . . . 0.0 108.245 171.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -87.9 114.93 24.98 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.185 1.394 . . . . 0.0 110.074 175.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -70.9 -10.28 59.34 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -85.38 -21.93 28.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.372 1.069 . . . . 0.0 113.225 170.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -81.01 148.73 65.05 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 124.371 1.069 . . . . 0.0 112.781 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.05 146.39 76.87 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.94 2.427 . . . . 0.0 110.931 169.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -61.67 -29.85 70.35 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.556 177.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -58.7 -46.06 88.15 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.209 0.913 . . . . 0.0 112.232 172.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.14 -40.68 98.27 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.605 -0.684 . . . . 0.0 112.09 176.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 90.3 mt -66.42 -48.97 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.473 0.709 . . . . 0.0 110.568 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.78 -36.88 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.389 1.076 . . . . 0.0 110.94 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.69 -40.5 92.46 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.791 0.836 . . . . 0.0 112.304 171.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -70.74 -25.81 63.09 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.355 1.062 . . . . 0.0 113.589 173.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.83 -61.93 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.865 1.211 . . . . 0.0 110.902 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.9 p -63.51 -33.79 76.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.777 0.831 . . . . 0.0 112.76 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.02 -28.61 69.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.905 0.882 . . . . 0.0 113.017 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.94 -23.24 69.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.242 0.925 . . . . 0.0 114.205 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -115.79 12.99 16.04 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.864 1.666 . . . . 0.0 113.172 173.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m 55.78 27.04 10.23 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.0 1.72 . . . . 0.0 114.589 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.53 130.8 37.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.212 1.405 . . . . 0.0 110.738 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.65 163.84 21.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.598 1.159 . . . . 0.0 113.789 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 52.61 68.81 0.77 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.686 1.994 . . . . 0.0 113.65 169.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -63.58 -17.77 63.19 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 -171.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -54.65 -32.95 59.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.505 1.522 . . . . 0.0 112.989 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -73.09 -21.29 60.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.388 1.075 . . . . 0.0 112.692 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -94.53 158.3 15.6 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.587 1.184 . . . . 0.0 114.159 -169.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.28 150.04 34.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.679 2.391 . . . . 0.0 109.725 173.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.3 mt -81.86 158.58 23.97 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 166.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -148.93 148.12 29.44 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.573 1.149 . . . . 0.0 110.243 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 N--CA 1.471 0.609 0 O-C-N 121.933 -0.48 . . . . 0.0 111.69 172.022 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.1 mm -76.07 136.54 24.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.764 0.792 . . . . 0.0 110.108 174.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.4 p -142.86 171.42 14.08 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.251 2.22 . . . . 0.0 108.768 -175.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -59.95 -18.15 43.25 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.361 -0.837 . . . . 0.0 113.131 176.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -89.59 -54.07 4.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.907 1.683 . . . . 0.0 111.391 168.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -69.6 -23.59 63.55 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.12 0.968 . . . . 0.0 113.126 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -55.46 -27.95 51.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -73.21 -18.06 61.29 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.334 1.054 . . . . 0.0 112.972 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -85.44 -13.97 47.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.668 1.187 . . . . 0.0 112.648 176.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.8 mt -66.54 137.85 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.657 1.183 . . . . 0.0 109.648 172.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -137.43 165.76 25.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.406 1.882 . . . . 0.0 111.828 -179.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.39 124.54 18.44 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.852 -0.53 . . . . 0.0 112.015 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.61 10.24 73.6 Favored Glycine 0 CA--C 1.539 1.532 0 C-N-CA 124.843 1.211 . . . . 0.0 115.514 -175.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 91.9 m -63.57 128.7 37.01 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.761 1.781 . . . . 0.0 110.792 175.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -86.82 123.23 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.6 mt -119.07 174.09 6.52 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.18 1.792 . . . . 0.0 110.957 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -139.2 135.5 34.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.544 1.938 . . . . 0.0 109.996 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.3 tp -79.47 135.9 36.78 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.071 0.548 . . . . 0.0 109.664 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.6 t -155.65 154.48 31.66 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.158 0.983 . . . . 0.0 110.216 -175.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.7 p -71.96 134.48 45.99 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.411 -1.431 . . . . 0.0 110.386 169.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t . . . . . 0 CA--C 1.537 0.465 0 C-N-CA 124.298 1.039 . . . . 0.0 110.614 174.532 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 120.857 0.361 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.0 m -129.55 126.41 63.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.585 1.554 . . . . 0.0 111.597 -178.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -74.13 140.23 45.08 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.981 0.912 . . . . 0.0 110.84 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 m -137.91 154.45 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.13 1.372 . . . . 0.0 111.83 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.08 38.8 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.946 1.298 . . . . 0.0 109.615 171.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.4 mt -110.18 123.95 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.725 0.81 . . . . 0.0 110.38 -170.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -88.57 153.32 21.22 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.886 1.274 . . . . 0.0 113.238 176.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -153.76 142.48 14.47 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 126.134 1.773 . . . . 0.0 109.658 169.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -60.12 133.94 53.09 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.51 2.14 . . . . 0.0 113.295 -175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.93 11.04 78.37 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 115.409 0.924 . . . . 0.0 115.409 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.49 151.56 51.46 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.975 1.387 . . . . 0.0 112.805 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -70.34 150.27 95.83 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.703 0.801 . . . . 0.0 111.371 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -61.09 130.18 31.53 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.421 2.08 . . . . 0.0 113.383 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -83.55 111.15 18.82 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.121 1.368 . . . . 0.0 110.124 175.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.43 132.47 39.68 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.674 0.79 . . . . 0.0 110.227 169.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -157.24 178.08 10.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.411 1.085 . . . . 0.0 111.688 177.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -122.21 131.25 53.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.492 1.117 . . . . 0.0 112.174 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 mt -100.19 109.79 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.636 1.575 . . . . 0.0 108.864 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -81.14 117.85 22.04 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 168.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -65.05 -13.89 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -86.22 -22.21 27.03 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.758 1.223 . . . . 0.0 114.087 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -86.13 149.56 50.34 Favored Pre-proline 0 N--CA 1.483 1.181 0 CA-C-N 119.778 1.172 . . . . 0.0 111.691 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.47 144.01 39.74 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.067 2.512 . . . . 0.0 112.337 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.4 mt -61.77 -31.73 71.95 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.445 0.698 . . . . 0.0 112.438 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.4 m -59.38 -42.4 91.61 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.168 0.894 . . . . 0.0 112.301 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.5 81.83 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.145 0.578 . . . . 0.0 111.902 175.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.81 -50.76 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.492 0.717 . . . . 0.0 110.581 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.5 mt -61.51 -38.54 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.073 -1.017 . . . . 0.0 110.865 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.3 -38.95 88.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.721 0.809 . . . . 0.0 112.552 171.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -72.25 -27.81 62.74 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.396 1.079 . . . . 0.0 113.488 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.41 -61.11 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.259 -0.9 . . . . 0.0 111.098 172.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 30.2 p -61.55 -33.45 73.86 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.582 0.753 . . . . 0.0 112.849 -171.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -60.27 -30.85 69.72 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.325 1.05 . . . . 0.0 112.893 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -23.13 67.93 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.378 0.989 . . . . 0.0 114.064 175.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -114.9 12.36 16.85 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.955 1.702 . . . . 0.0 113.307 173.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.3 p 55.93 22.67 5.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 127.284 2.233 . . . . 0.0 115.4 -176.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.62 125.99 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.083 1.353 . . . . 0.0 110.677 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.0 166.2 22.6 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.636 1.174 . . . . 0.0 113.4 -177.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 m120 54.06 63.13 2.29 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.984 1.714 . . . . 0.0 113.397 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -59.85 -25.44 65.03 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.208 -0.933 . . . . 0.0 113.482 -174.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -64.73 -15.84 62.08 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.852 1.261 . . . . 0.0 113.89 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -77.81 -20.87 52.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.161 -0.962 . . . . 0.0 112.407 168.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -94.38 160.81 14.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.903 1.281 . . . . 0.0 114.145 -169.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.43 157.38 43.76 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.829 2.451 . . . . 0.0 109.917 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 40.3 mt -87.41 151.69 22.86 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 167.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -139.22 144.4 38.46 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.813 1.245 . . . . 0.0 109.959 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 . . . . . 0 N--CA 1.471 0.58 0 C-N-CA 123.061 0.544 . . . . 0.0 112.377 176.914 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 . . . . . 0 N--CA 1.469 0.494 0 CA-C-O 121.051 0.453 . . . . 0.0 110.645 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -77.92 134.06 29.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.507 0.723 . . . . 0.0 109.673 173.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -139.31 169.55 17.56 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.97 1.708 . . . . 0.0 109.776 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -58.41 -21.29 50.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.099 0.96 . . . . 0.0 113.385 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -93.59 -47.48 6.8 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.295 1.438 . . . . 0.0 112.667 169.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -76.64 -17.25 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -54.29 -25.45 23.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.967 1.307 . . . . 0.0 114.231 171.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -67.54 -15.87 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.072 0.949 . . . . 0.0 113.512 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -79.17 -11.63 59.97 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.077 0.951 . . . . 0.0 113.426 171.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.0 mt -71.53 134.47 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 O-C-N 121.272 -0.893 . . . . 0.0 109.771 173.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -121.5 166.36 14.27 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.843 2.057 . . . . 0.0 111.629 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -57.57 124.03 17.64 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 121.855 -0.528 . . . . 0.0 110.738 173.257 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.51 11.59 68.54 Favored Glycine 0 CA--C 1.539 1.549 0 C-N-CA 125.11 1.338 . . . . 0.0 115.465 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.4 m -65.12 131.62 47.02 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 119.455 1.628 . . . . 0.0 111.599 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.3 mt -85.31 124.4 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 169.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.6 mt -119.46 174.65 6.25 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.845 2.058 . . . . 0.0 110.263 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -141.92 137.46 31.32 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.938 1.695 . . . . 0.0 110.181 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -77.09 139.84 40.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.956 0.902 . . . . 0.0 110.595 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.2 t -157.35 151.38 24.6 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.976 0.911 . . . . 0.0 111.242 -176.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.0 p -69.86 126.71 30.51 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.565 -1.335 . . . . 0.0 110.321 169.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 45.0 t . . . . . 0 CA--C 1.536 0.424 0 C-N-CA 125.121 1.369 . . . . 0.0 111.875 -177.769 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.6 mt . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -135.48 132.82 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.056 1.342 . . . . 0.0 112.136 -177.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -71.34 141.14 50.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.98 0.912 . . . . 0.0 111.396 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.3 m -141.81 155.14 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.942 1.297 . . . . 0.0 111.927 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.16 39.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.898 1.279 . . . . 0.0 109.792 171.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -109.18 125.23 66.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.922 0.889 . . . . 0.0 110.48 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -91.89 151.05 20.73 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.879 1.272 . . . . 0.0 113.381 177.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -151.35 143.38 16.08 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.069 1.748 . . . . 0.0 109.937 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -59.67 135.16 62.25 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.544 2.162 . . . . 0.0 113.505 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.58 11.32 76.92 Favored Glycine 0 CA--C 1.539 1.571 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -132.81 152.37 51.82 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.873 1.336 . . . . 0.0 112.866 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -70.44 152.18 95.51 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 123.689 0.796 . . . . 0.0 111.515 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.34 129.72 29.37 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.5 2.133 . . . . 0.0 113.265 -178.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -82.56 109.31 16.65 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.205 1.402 . . . . 0.0 110.05 174.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.8 131.9 40.06 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.723 0.809 . . . . 0.0 110.205 170.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -156.48 178.19 10.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.198 0.999 . . . . 0.0 112.067 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -118.58 122.45 42.65 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.701 1.2 . . . . 0.0 111.474 174.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.3 mt -84.78 108.46 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 124.425 1.09 . . . . 0.0 108.257 169.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -81.77 114.86 20.7 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.094 0.957 . . . . 0.0 108.825 169.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.01 -12.07 60.1 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -175.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -88.44 -23.06 23.39 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.761 1.224 . . . . 0.0 113.422 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -78.94 143.07 61.1 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.182 0.993 . . . . 0.0 111.295 174.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.52 144.41 66.75 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.089 2.526 . . . . 0.0 111.411 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -61.69 -30.06 70.5 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 118.78 -0.629 . . . . 0.0 112.615 178.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.3 p -59.98 -44.68 94.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.644 1.111 . . . . 0.0 112.402 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.72 -40.02 88.25 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.263 0.625 . . . . 0.0 112.055 174.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.7 -46.89 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.585 0.754 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.05 -37.02 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.581 1.153 . . . . 0.0 111.077 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -61.49 -38.62 87.97 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.743 0.701 . . . . 0.0 112.32 171.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -72.03 -25.13 61.69 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.329 1.052 . . . . 0.0 113.337 174.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 46.4 t -72.07 -57.6 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.277 0.944 . . . . 0.0 110.976 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.7 p -62.18 -33.76 75.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.865 0.866 . . . . 0.0 112.562 -169.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.17 -28.94 69.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.557 1.143 . . . . 0.0 113.029 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.11 -23.0 69.41 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.303 0.954 . . . . 0.0 114.088 175.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -117.73 10.28 13.28 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.052 1.741 . . . . 0.0 113.193 174.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.0 t 54.69 33.6 19.77 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.274 1.83 . . . . 0.0 113.865 -176.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -80.69 125.21 29.75 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.708 1.203 . . . . 0.0 110.489 179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.26 165.82 22.81 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.77 1.228 . . . . 0.0 113.245 -178.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 54.03 59.83 4.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.922 1.689 . . . . 0.0 113.569 172.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -60.24 -19.97 56.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -176.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -56.27 -29.27 60.9 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.237 1.415 . . . . 0.0 112.913 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -78.9 -19.75 51.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.015 0.926 . . . . 0.0 112.726 178.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -91.16 158.32 16.69 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -169.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.73 150.67 35.82 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.354 2.262 . . . . 0.0 110.086 172.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -82.54 153.45 25.53 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 167.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -145.4 150.36 36.4 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.826 1.25 . . . . 0.0 109.698 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 . . . . . 0 N--CA 1.474 0.747 0 O-C-N 121.487 -0.758 . . . . 0.0 111.146 173.267 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 CA--C 1.536 0.412 0 CA-C-O 121.445 0.64 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.4 mm -82.19 129.6 37.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 124.375 1.07 . . . . 0.0 109.283 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.7 p -142.53 167.19 22.68 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.619 1.568 . . . . 0.0 109.965 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -63.1 -10.01 12.91 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 120.979 -1.076 . . . . 0.0 113.451 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -105.68 -4.88 20.49 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.517 1.927 . . . . 0.0 114.406 173.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -130.22 -14.48 3.83 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -174.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.55 -18.47 59.38 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 178.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.47 -22.58 66.97 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.869 1.268 . . . . 0.0 112.959 174.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -75.15 -14.17 60.53 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.987 0.915 . . . . 0.0 113.184 177.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -73.77 132.64 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.472 1.109 . . . . 0.0 110.172 177.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -118.13 167.31 11.6 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.144 1.778 . . . . 0.0 111.886 170.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -59.41 127.27 31.23 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.633 -0.667 . . . . 0.0 110.979 172.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.77 10.35 69.96 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.041 1.305 . . . . 0.0 115.305 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.5 m -65.98 131.39 46.13 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.563 1.682 . . . . 0.0 111.084 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mt -89.74 125.02 42.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 172.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 89.5 mt -120.37 173.45 7.13 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.679 1.992 . . . . 0.0 110.578 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -139.83 146.88 39.93 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.793 1.637 . . . . 0.0 110.594 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.7 tp -85.22 138.98 32.0 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.219 1.008 . . . . 0.0 110.173 173.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.7 t -157.65 156.37 31.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.157 0.983 . . . . 0.0 110.871 -176.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.4 p -71.02 139.26 50.43 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.415 -1.428 . . . . 0.0 110.568 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.9 p . . . . . 0 CA--C 1.543 0.675 0 C-N-CA 126.011 1.724 . . . . 0.0 113.635 -171.041 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.6 mt . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 121.119 0.485 . . . . 0.0 111.416 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.5 m -133.67 135.36 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.033 1.733 . . . . 0.0 111.52 178.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.3 tttp -77.91 145.88 35.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.168 0.987 . . . . 0.0 110.873 172.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.9 m -141.73 155.5 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.777 1.631 . . . . 0.0 111.563 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.62 113.28 20.99 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.922 1.289 . . . . 0.0 109.992 174.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.7 mt -102.07 126.21 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.763 0.825 . . . . 0.0 110.839 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -82.9 143.1 30.96 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.722 1.609 . . . . 0.0 112.754 175.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -156.03 142.99 13.58 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.817 1.647 . . . . 0.0 110.429 170.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -63.24 143.9 90.55 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.699 2.266 . . . . 0.0 113.775 -174.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.84 71.42 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 115.476 0.95 . . . . 0.0 115.476 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -142.11 157.32 45.03 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.201 1.4 . . . . 0.0 112.641 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -70.21 154.1 94.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 123.762 0.825 . . . . 0.0 111.452 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.86 129.8 32.12 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.647 2.232 . . . . 0.0 112.746 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -81.15 109.63 15.88 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.095 0.958 . . . . 0.0 110.303 176.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.4 mt -76.91 126.16 30.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.48 0.712 . . . . 0.0 109.664 169.447 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.4 ptm -154.15 178.47 9.95 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.115 0.966 . . . . 0.0 111.766 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -115.96 137.72 51.85 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.401 1.081 . . . . 0.0 111.983 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.8 mt -105.33 114.03 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 C-N-CA 126.014 1.726 . . . . 0.0 108.717 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -87.53 119.93 28.33 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.887 0.875 . . . . 0.0 109.071 168.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -65.93 -15.07 62.64 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -83.95 -21.2 31.88 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.621 1.168 . . . . 0.0 113.977 172.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -80.2 146.97 63.81 Favored Pre-proline 0 N--CA 1.481 1.08 0 CA-C-N 119.386 0.994 . . . . 0.0 111.902 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.67 142.42 52.98 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.724 2.283 . . . . 0.0 111.06 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.5 mt -62.82 -29.61 70.86 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.298 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.6 p -60.83 -44.12 97.37 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.419 1.009 . . . . 0.0 112.576 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.87 87.63 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.574 0.625 . . . . 0.0 112.096 175.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.56 -48.38 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.345 0.658 . . . . 0.0 110.282 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -36.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.458 1.103 . . . . 0.0 111.213 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.68 -44.7 93.51 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.146 0.885 . . . . 0.0 112.066 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -66.51 -29.31 69.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.338 1.055 . . . . 0.0 113.074 174.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.92 -55.43 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.343 0.974 . . . . 0.0 110.514 169.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.07 -41.3 99.41 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.835 0.854 . . . . 0.0 112.182 -173.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.81 -27.29 68.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.634 0.774 . . . . 0.0 112.91 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.63 -23.58 67.15 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.425 1.012 . . . . 0.0 114.3 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -117.51 16.19 14.64 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.92 1.688 . . . . 0.0 113.144 172.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.1 m 55.59 26.42 9.14 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.92 1.688 . . . . 0.0 114.55 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.3 mt -72.46 125.41 27.35 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.113 1.365 . . . . 0.0 111.405 -178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.16 152.93 41.95 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.353 1.061 . . . . 0.0 112.352 176.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 49.27 68.11 0.78 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.458 1.903 . . . . 0.0 113.232 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -57.45 -17.25 12.29 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.971 1.308 . . . . 0.0 113.425 177.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -54.86 -27.93 46.21 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.705 1.602 . . . . 0.0 112.914 173.411 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -76.61 -18.37 58.65 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.938 0.895 . . . . 0.0 112.87 178.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -95.82 159.96 14.72 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -168.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.42 145.82 32.13 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.584 2.354 . . . . 0.0 109.563 172.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.46 154.96 28.53 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.456 0.646 . . . . 0.0 109.27 167.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -144.95 149.16 34.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 124.973 1.309 . . . . 0.0 110.019 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 . . . . . 0 N--CA 1.47 0.557 0 O-C-N 121.678 -0.639 . . . . 0.0 111.871 170.823 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.6 mm -74.59 135.45 27.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.169 0.588 . . . . 0.0 110.291 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 p -142.12 173.02 11.9 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.775 2.03 . . . . 0.0 109.436 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -57.82 -22.69 48.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -90.32 -48.94 6.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.824 1.25 . . . . 0.0 112.362 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -74.79 -20.13 59.92 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.162 0.985 . . . . 0.0 113.306 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -54.99 -26.53 37.5 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.423 1.089 . . . . 0.0 113.843 171.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -72.6 -15.92 61.73 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.317 1.047 . . . . 0.0 113.376 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.22 -13.04 60.02 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.162 0.985 . . . . 0.0 112.894 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.0 mt -70.52 129.99 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.98 0.912 . . . . 0.0 109.65 174.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -111.47 165.29 12.11 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.247 1.819 . . . . 0.0 111.867 170.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -61.29 125.5 23.97 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.604 -0.685 . . . . 0.0 110.929 174.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.67 13.71 69.44 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.039 1.304 . . . . 0.0 115.392 -174.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.0 m -64.55 131.0 45.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 119.763 1.782 . . . . 0.0 111.69 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.6 mt -80.68 121.32 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 168.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -113.91 177.96 4.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.333 1.853 . . . . 0.0 110.455 176.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -143.18 136.27 27.98 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 126.813 2.045 . . . . 0.0 110.285 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.4 tp -82.11 137.65 34.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.274 0.63 . . . . 0.0 109.734 169.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.1 t -155.87 154.63 31.57 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.121 0.968 . . . . 0.0 110.241 -177.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.5 p -70.03 141.0 52.94 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.547 -1.346 . . . . 0.0 110.571 170.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.2 t . . . . . 0 CA--C 1.542 0.656 0 C-N-CA 125.767 1.627 . . . . 0.0 113.164 -172.982 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 19.6 mt . . . . . 0 N--CA 1.47 0.572 0 CA-C-O 121.14 0.495 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.41 129.83 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 126.27 1.828 . . . . 0.0 110.867 175.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -73.61 143.32 46.41 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.956 0.902 . . . . 0.0 110.397 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.36 151.36 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.196 1.398 . . . . 0.0 111.171 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.09 129.01 56.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.526 1.13 . . . . 0.0 109.95 171.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -118.44 122.58 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.865 0.866 . . . . 0.0 110.821 -169.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -81.73 141.54 33.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.276 1.43 . . . . 0.0 112.86 175.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TRP . . . . . 0.43 ' CD2' ' HD2' ' A' ' 15' ' ' PRO . 68.6 t-105 -158.84 139.53 9.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.677 1.991 . . . . 0.0 109.626 169.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.43 ' HD2' ' CD2' ' A' ' 14' ' ' TRP . 59.2 Cg_endo -68.08 150.59 77.49 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.131 2.554 . . . . 0.0 113.204 -173.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 73.46 9.96 78.55 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.188 0.899 . . . . 0.0 115.151 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.12 160.5 42.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.635 1.574 . . . . 0.0 112.248 -178.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -71.28 155.94 92.32 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.008 0.923 . . . . 0.0 111.743 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.36 126.95 22.24 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.871 2.381 . . . . 0.0 112.312 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -83.76 115.77 22.38 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.101 0.96 . . . . 0.0 110.973 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.48 130.93 35.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.247 0.619 . . . . 0.0 109.808 168.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -151.16 173.66 14.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.537 1.135 . . . . 0.0 110.998 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -126.79 114.23 17.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.21 1.004 . . . . 0.0 111.513 -173.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.7 mt -86.4 116.02 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 125.476 1.51 . . . . 0.0 109.744 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -82.51 117.84 22.81 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 167.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.0 -9.64 41.13 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -91.34 -19.89 22.44 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 170.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -87.16 148.58 45.32 Favored Pre-proline 0 N--CA 1.485 1.309 0 CA-C-N 120.225 1.375 . . . . 0.0 111.967 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.57 146.92 56.46 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.415 2.743 . . . . 0.0 112.577 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.84 -30.14 71.26 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 118.245 -0.883 . . . . 0.0 113.103 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.2 t -58.92 -45.23 90.83 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.991 1.269 . . . . 0.0 111.61 173.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.23 95.33 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.765 -0.584 . . . . 0.0 112.26 175.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 60.6 mt -60.9 -51.91 67.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.683 0.793 . . . . 0.0 111.251 175.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.4 mt -61.57 -39.83 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 123.943 0.897 . . . . 0.0 110.017 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -58.57 -43.61 89.45 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.758 0.708 . . . . 0.0 112.368 171.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -69.91 -26.33 64.11 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.565 1.146 . . . . 0.0 112.903 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.6 t -71.0 -61.39 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.919 0.888 . . . . 0.0 110.093 169.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -55.37 -39.2 69.82 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.56 1.544 . . . . 0.0 113.764 -173.072 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.87 -29.77 68.53 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.56 -29.79 72.94 Favored Glycine 0 CA--C 1.534 1.257 0 O-C-N 121.291 -0.881 . . . . 0.0 113.897 177.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -99.22 14.03 30.91 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.192 1.397 . . . . 0.0 112.883 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p 57.67 20.68 6.56 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.467 2.307 . . . . 0.0 115.322 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -72.39 113.42 9.42 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.877 1.271 . . . . 0.0 110.889 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.18 162.99 28.39 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.308 1.043 . . . . 0.0 112.207 174.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.5 m120 54.16 65.26 1.56 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.724 1.609 . . . . 0.0 112.777 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 32.3 p-80 -62.77 -14.34 43.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.353 1.061 . . . . 0.0 113.333 -177.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -54.57 -29.48 51.38 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.274 1.83 . . . . 0.0 113.407 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -74.98 -21.22 59.28 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.545 1.138 . . . . 0.0 112.86 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -98.24 160.01 14.57 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -168.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.24 156.42 39.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.305 2.242 . . . . 0.0 110.137 169.261 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.7 mt -80.32 154.53 27.73 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 167.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -142.17 144.8 33.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.655 1.182 . . . . 0.0 110.372 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 178.134 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 . . . . . 0 CA--C 1.537 0.446 0 CA-C-O 121.0 0.429 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mm -80.14 135.65 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.849 0.859 . . . . 0.0 110.409 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -143.78 168.93 18.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.15 2.18 . . . . 0.0 108.86 -177.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -61.3 -15.55 36.63 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.367 -0.833 . . . . 0.0 113.229 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -87.99 -50.4 6.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.321 1.448 . . . . 0.0 112.082 168.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -77.22 -19.63 56.41 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.992 1.317 . . . . 0.0 114.375 -168.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -58.32 -17.91 23.39 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -66.23 -19.21 65.76 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 173.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -75.43 -16.14 60.37 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.134 0.974 . . . . 0.0 113.113 173.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.9 mt -75.67 128.65 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 123.967 0.907 . . . . 0.0 109.688 177.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -120.6 168.38 11.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.255 1.822 . . . . 0.0 111.842 171.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -61.16 121.96 13.84 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.613 -0.679 . . . . 0.0 111.312 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.23 10.19 62.61 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.438 1.494 . . . . 0.0 115.594 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.0 m -64.81 131.33 46.5 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 119.692 1.746 . . . . 0.0 111.861 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 43.7 mt -87.2 125.9 40.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.85 0.86 . . . . 0.0 109.784 169.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.1 mt -124.79 176.75 6.39 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.877 2.471 . . . . 0.0 109.924 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt85 -136.61 149.07 47.81 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.846 1.259 . . . . 0.0 110.814 168.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.2 tp -82.98 138.81 33.63 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.52 156.53 32.19 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.165 0.986 . . . . 0.0 110.67 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 26.8 p -70.63 132.44 45.45 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.62 -1.3 . . . . 0.0 110.418 169.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 p . . . . . 0 CA--C 1.545 0.764 0 C-N-CA 125.339 1.456 . . . . 0.0 112.498 -176.753 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.0 mt . . . . . 0 N--CA 1.469 0.51 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 10.3 m -129.79 127.47 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.19 1.396 . . . . 0.0 111.594 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -75.83 141.56 42.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.006 0.922 . . . . 0.0 111.03 175.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -140.68 156.83 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.498 1.519 . . . . 0.0 111.936 -176.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.28 116.24 26.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.789 1.235 . . . . 0.0 109.945 170.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.71 126.1 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 124.303 1.041 . . . . 0.0 110.568 -171.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -84.56 146.92 27.29 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.262 1.425 . . . . 0.0 113.147 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -153.34 142.18 14.43 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 125.941 1.696 . . . . 0.0 110.167 169.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -62.07 138.67 74.33 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.66 2.24 . . . . 0.0 113.592 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.73 13.21 71.58 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.355 0.902 . . . . 0.0 115.355 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.8 154.22 50.6 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.263 1.425 . . . . 0.0 112.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -68.56 148.35 98.1 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 123.522 0.729 . . . . 0.0 111.059 170.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.34 129.91 33.5 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.548 2.165 . . . . 0.0 113.064 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -81.08 111.62 17.7 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.64 1.176 . . . . 0.0 110.347 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -77.03 127.51 32.81 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.328 0.651 . . . . 0.0 109.651 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -154.86 178.18 10.45 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.014 0.925 . . . . 0.0 111.833 173.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -115.8 136.44 53.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.453 1.101 . . . . 0.0 111.924 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.0 mt -105.1 107.43 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 125.794 1.637 . . . . 0.0 108.225 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -78.34 117.04 19.2 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 168.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -67.07 -13.39 61.88 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -87.36 -21.96 25.35 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.188 0.995 . . . . 0.0 113.681 173.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -75.99 148.35 81.49 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 124.469 1.108 . . . . 0.0 111.852 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.02 139.34 42.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.978 2.452 . . . . 0.0 111.04 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.4 mt -61.44 -31.13 71.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.35 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.7 t -60.02 -44.51 94.56 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.56 1.073 . . . . 0.0 112.291 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -39.84 93.5 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.659 -0.651 . . . . 0.0 112.026 175.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.5 mt -65.03 -46.49 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.166 0.586 . . . . 0.0 110.619 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.1 mt -60.26 -38.2 76.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.658 1.183 . . . . 0.0 111.138 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -61.69 -40.15 93.97 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.4 0.68 . . . . 0.0 112.316 172.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -69.31 -25.66 64.34 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.396 1.078 . . . . 0.0 113.167 173.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.35 -58.99 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.438 1.017 . . . . 0.0 110.564 169.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.3 p -65.08 -35.05 79.92 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.238 0.615 . . . . 0.0 112.348 -169.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.53 -29.0 68.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.055 0.942 . . . . 0.0 112.922 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -22.98 68.47 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.421 1.01 . . . . 0.0 114.263 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -115.48 10.71 15.78 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.022 1.729 . . . . 0.0 113.053 172.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.1 t 54.96 31.1 15.29 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.049 1.74 . . . . 0.0 114.169 -175.428 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.41 125.42 29.51 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.707 1.203 . . . . 0.0 109.908 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.83 159.23 30.24 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 113.586 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 51.6 75.78 0.19 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.081 2.153 . . . . 0.0 113.325 170.531 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -62.33 -17.82 59.81 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.485 1.114 . . . . 0.0 113.661 -173.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -55.31 -30.88 61.07 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.224 1.41 . . . . 0.0 112.68 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -73.55 -23.49 59.98 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.155 0.582 . . . . 0.0 112.22 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -94.85 158.03 15.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.801 1.24 . . . . 0.0 114.331 -169.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.71 148.41 35.66 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.731 2.013 . . . . 0.0 109.748 169.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.29 148.33 35.76 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 167.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -141.39 153.99 45.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.344 1.458 . . . . 0.0 109.375 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 . . . . . 0 CA--C 1.535 0.401 0 O-C-N 121.314 -0.866 . . . . 0.0 112.427 171.77 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 N--CA 1.471 0.594 0 CA-C-O 121.027 0.441 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.82 131.15 34.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.096 0.958 . . . . 0.0 110.238 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -146.9 169.48 19.07 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.155 1.782 . . . . 0.0 110.102 -176.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -60.03 -18.0 43.03 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.734 -1.229 . . . . 0.0 113.458 172.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -96.0 -8.06 34.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.988 1.715 . . . . 0.0 114.296 175.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -133.69 -13.28 2.58 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 -172.341 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -59.95 -23.31 63.46 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 120.581 -1.324 . . . . 0.0 114.105 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -61.78 -22.69 65.65 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.394 1.478 . . . . 0.0 113.279 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -73.75 -19.55 60.75 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.641 0.777 . . . . 0.0 112.863 177.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 51.3 mt -68.76 132.71 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.97 0.908 . . . . 0.0 109.603 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -135.48 165.51 25.34 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.651 1.98 . . . . 0.0 111.882 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -57.62 116.04 3.15 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.332 0.653 . . . . 0.0 111.362 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.15 11.58 56.03 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.59 1.567 . . . . 0.0 115.568 -176.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.9 m -65.85 133.12 50.28 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.606 1.703 . . . . 0.0 111.781 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -85.19 121.97 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 170.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -118.7 -179.89 3.94 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.734 2.013 . . . . 0.0 110.873 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -148.55 137.45 21.6 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 127.331 2.252 . . . . 0.0 110.256 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 tp -85.27 137.88 32.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.754 0.821 . . . . 0.0 109.993 169.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.2 t -157.19 151.86 25.5 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.812 0.845 . . . . 0.0 110.917 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.3 p -71.03 132.63 45.43 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.988 -1.07 . . . . 0.0 110.298 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.9 p . . . . . 0 CA--C 1.541 0.616 0 C-N-CA 125.462 1.505 . . . . 0.0 114.199 -169.292 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.5 mt . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 m -129.44 132.17 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.937 1.295 . . . . 0.0 112.01 -177.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -69.15 146.42 52.49 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.761 0.824 . . . . 0.0 110.756 170.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m -143.69 151.58 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.408 1.483 . . . . 0.0 111.521 176.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.87 116.75 28.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.665 1.186 . . . . 0.0 109.854 173.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.7 mt -106.7 123.96 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.907 0.883 . . . . 0.0 110.823 -169.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -82.7 144.69 30.06 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.236 1.414 . . . . 0.0 112.933 174.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -154.83 143.44 14.67 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 126.003 1.721 . . . . 0.0 110.079 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -63.02 143.21 90.46 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.605 2.203 . . . . 0.0 113.789 -173.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.5 12.27 73.2 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 178.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.91 155.79 45.5 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.181 1.392 . . . . 0.0 112.702 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -69.47 152.86 96.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 123.803 0.841 . . . . 0.0 111.371 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.99 128.9 29.52 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.596 2.198 . . . . 0.0 113.17 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -78.29 111.32 14.14 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.623 1.169 . . . . 0.0 110.148 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.3 127.67 32.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.316 0.646 . . . . 0.0 109.584 169.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.4 ptm -152.63 -178.52 6.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.035 0.934 . . . . 0.0 111.67 172.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -122.44 129.64 52.26 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.49 1.116 . . . . 0.0 111.572 178.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.2 mt -96.26 112.87 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 C-N-CA 125.311 1.444 . . . . 0.0 108.664 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.99 120.47 26.15 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 167.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -64.92 -11.09 34.28 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -87.22 -21.9 25.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.944 1.298 . . . . 0.0 114.345 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -77.97 141.87 63.88 Favored Pre-proline 0 N--CA 1.483 1.191 0 CA-C-N 119.831 1.196 . . . . 0.0 111.513 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.19 144.22 56.32 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.333 2.688 . . . . 0.0 111.543 177.124 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.1 mt -63.72 -29.97 71.13 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.071 -0.966 . . . . 0.0 113.097 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.0 t -61.13 -44.82 96.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.397 1.453 . . . . 0.0 111.898 174.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.11 95.52 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.567 -0.708 . . . . 0.0 112.194 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.12 -50.41 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.399 0.679 . . . . 0.0 110.502 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.01 -35.66 69.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.299 1.04 . . . . 0.0 110.946 -179.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.02 -43.33 95.34 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.041 0.837 . . . . 0.0 112.081 170.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -68.74 -29.69 68.16 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.732 1.213 . . . . 0.0 113.121 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.16 -53.66 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 121.292 -0.88 . . . . 0.0 110.155 169.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.0 m -61.4 -43.73 98.37 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.161 0.984 . . . . 0.0 111.986 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -60.34 -29.72 69.07 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.098 0.959 . . . . 0.0 112.847 175.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.32 -23.58 62.45 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.395 0.998 . . . . 0.0 114.436 173.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.71 16.86 14.45 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.97 1.708 . . . . 0.0 113.25 171.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.0 p 56.33 21.02 5.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.281 2.232 . . . . 0.0 115.536 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -68.41 123.92 22.1 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.447 1.499 . . . . 0.0 111.423 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.89 158.73 31.72 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.445 1.098 . . . . 0.0 112.365 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 50.52 68.41 0.77 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.491 1.916 . . . . 0.0 112.998 173.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -62.2 -15.72 48.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.558 1.143 . . . . 0.0 113.158 -177.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -55.99 -26.92 50.59 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.754 1.622 . . . . 0.0 113.197 176.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -77.77 -15.9 58.77 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -98.18 157.65 16.03 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -168.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.65 149.24 35.35 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 127.297 2.239 . . . . 0.0 109.53 169.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -78.39 157.16 29.14 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -145.85 147.82 32.22 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.792 1.237 . . . . 0.0 110.157 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 . . . . . 0 N--CA 1.475 0.786 0 O-C-N 121.629 -0.669 . . . . 0.0 110.906 173.37 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.103 0.478 . . . . 0.0 110.005 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.1 mm -80.6 136.64 22.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.115 0.966 . . . . 0.0 110.083 175.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.0 p -144.43 169.51 17.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.236 2.214 . . . . 0.0 108.553 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -62.19 -11.78 16.41 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 177.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.76 -44.97 6.85 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.352 1.461 . . . . 0.0 112.509 168.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -76.25 -21.64 56.11 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.486 1.114 . . . . 0.0 113.509 -172.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -57.15 -22.23 38.63 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 176.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -66.86 -18.51 65.41 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.401 1.081 . . . . 0.0 113.377 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -79.83 -11.26 59.83 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.288 1.035 . . . . 0.0 113.452 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.4 mt -76.14 133.03 31.99 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.311 1.044 . . . . 0.0 109.651 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.75 166.89 15.39 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.724 2.01 . . . . 0.0 111.804 173.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -60.65 118.89 7.13 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.823 -0.548 . . . . 0.0 111.41 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.16 14.34 56.17 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 125.293 1.425 . . . . 0.0 115.436 -175.227 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -65.33 130.62 43.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.77 1.785 . . . . 0.0 111.28 177.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mt -84.29 121.92 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 170.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -117.88 174.62 6.08 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.255 1.822 . . . . 0.0 110.671 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -141.92 133.84 27.33 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 126.239 1.816 . . . . 0.0 109.976 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 tp -79.47 136.8 37.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.194 0.598 . . . . 0.0 110.138 170.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.3 t -157.53 151.0 23.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.421 1.088 . . . . 0.0 110.11 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.9 p -72.0 138.57 48.06 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.493 -1.38 . . . . 0.0 110.388 169.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p . . . . . 0 CA--C 1.544 0.712 0 C-N-CA 123.954 0.902 . . . . 0.0 112.234 -175.56 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.1 mt . . . . . 0 N--CA 1.47 0.57 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 m -129.02 123.3 58.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.484 1.114 . . . . 0.0 112.745 -173.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -72.86 137.72 45.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.37 1.468 . . . . 0.0 111.261 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.7 m -139.34 157.01 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.511 1.524 . . . . 0.0 111.956 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.54 118.47 32.73 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.817 1.247 . . . . 0.0 109.837 171.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.5 mt -106.03 123.97 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.805 0.842 . . . . 0.0 110.882 -171.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -85.53 143.57 28.43 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.062 1.745 . . . . 0.0 113.025 176.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -156.46 142.09 12.7 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.086 1.754 . . . . 0.0 110.1 169.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -59.12 145.88 96.25 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.999 2.466 . . . . 0.0 114.493 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.1 11.46 74.89 Favored Glycine 0 CA--C 1.539 1.56 0 N-CA-C 115.607 1.003 . . . . 0.0 115.607 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -144.72 158.6 43.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.104 1.361 . . . . 0.0 112.695 -177.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -70.65 155.42 93.42 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.012 0.925 . . . . 0.0 111.662 170.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -60.65 130.18 32.31 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.653 2.235 . . . . 0.0 112.732 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -82.74 108.74 16.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.354 1.061 . . . . 0.0 110.453 176.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.7 mt -76.4 128.03 34.03 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 110.17 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -155.3 175.37 13.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.411 1.084 . . . . 0.0 111.638 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -122.71 118.32 27.81 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.383 1.073 . . . . 0.0 111.584 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.8 mt -83.79 110.54 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 125.227 1.411 . . . . 0.0 108.848 175.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -81.95 116.48 21.6 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 169.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.68 -12.71 55.92 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.0 -26.63 26.97 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.35 0.977 . . . . 0.0 113.489 171.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -77.45 142.48 67.06 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.02 0.928 . . . . 0.0 111.396 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.22 143.15 63.48 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.12 2.547 . . . . 0.0 111.296 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.2 mt -60.69 -31.39 70.64 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.442 178.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.8 p -59.18 -45.4 91.12 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.597 1.09 . . . . 0.0 112.45 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.77 89.48 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.178 0.591 . . . . 0.0 112.109 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.73 -47.54 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.647 0.779 . . . . 0.0 110.843 177.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.52 -37.73 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.589 1.156 . . . . 0.0 110.761 178.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -62.93 -38.47 91.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 172.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -71.02 -23.94 62.27 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.262 1.025 . . . . 0.0 113.074 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 73.2 t -73.14 -62.32 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 O-C-N 121.107 -0.996 . . . . 0.0 111.005 169.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.8 p -59.74 -30.98 69.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.94 1.296 . . . . 0.0 113.652 -169.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.85 -28.38 67.47 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.573 1.149 . . . . 0.0 113.346 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.68 -26.08 74.83 Favored Glycine 0 CA--C 1.534 1.232 0 O-C-N 121.332 -0.855 . . . . 0.0 114.011 177.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.0 m0 -107.67 11.09 28.77 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.668 1.587 . . . . 0.0 112.84 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.8 m 55.41 29.23 12.77 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.157 1.783 . . . . 0.0 114.065 -176.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -80.51 121.01 25.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.602 1.161 . . . . 0.0 110.332 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.7 165.85 23.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.78 1.232 . . . . 0.0 113.214 -178.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 54.15 63.75 2.07 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.037 1.735 . . . . 0.0 113.417 173.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -59.77 -21.8 61.26 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.958 0.903 . . . . 0.0 113.35 -176.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -55.95 -28.92 59.14 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.211 1.405 . . . . 0.0 113.127 172.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -77.77 -16.81 58.12 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.785 0.834 . . . . 0.0 112.624 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -96.99 159.64 14.79 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -169.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.27 156.35 43.31 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.152 2.581 . . . . 0.0 109.78 171.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.0 mt -89.5 156.02 18.91 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 166.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -148.25 147.34 29.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.979 0.912 . . . . 0.0 110.998 -177.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 52.2 m-70 . . . . . 0 N--CA 1.472 0.626 0 C-N-CA 123.336 0.654 . . . . 0.0 112.036 174.987 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 . . . . . 0 CA--C 1.539 0.519 0 CA-C-O 121.189 0.519 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mm -82.14 130.22 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 123.988 0.915 . . . . 0.0 109.545 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.5 p -143.69 166.77 23.94 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.786 1.634 . . . . 0.0 109.78 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.57 -13.16 27.97 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.853 -1.154 . . . . 0.0 113.345 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -97.91 -13.59 21.12 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.123 1.769 . . . . 0.0 114.417 173.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -126.3 -11.74 6.31 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -60.74 -18.88 57.38 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -62.4 -22.13 65.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.807 1.243 . . . . 0.0 113.112 174.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -75.02 -13.15 60.47 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.062 0.945 . . . . 0.0 113.357 177.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 65.3 mt -73.37 134.48 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.321 1.049 . . . . 0.0 110.079 175.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -126.85 166.38 17.57 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.227 1.811 . . . . 0.0 111.442 174.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -56.92 125.09 20.96 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.761 -0.587 . . . . 0.0 111.321 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.7 9.29 68.89 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.238 1.399 . . . . 0.0 115.343 -176.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 99.0 m -66.0 130.07 41.99 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.498 1.649 . . . . 0.0 111.255 177.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.8 mt -87.0 124.77 40.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 170.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.4 mt -118.21 172.46 7.42 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.239 1.815 . . . . 0.0 110.723 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.7 ttt-85 -132.11 140.38 48.79 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 126.745 2.018 . . . . 0.0 110.049 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.96 140.19 38.07 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 167.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -158.25 152.84 24.69 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.308 -0.87 . . . . 0.0 111.028 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.1 p -73.6 135.15 43.83 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.568 -1.332 . . . . 0.0 110.856 170.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 126.434 1.893 . . . . 0.0 114.421 -168.71 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 ttp -150.32 136.66 10.86 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 125.239 1.415 . . . . 0.0 110.804 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -70.73 162.87 41.05 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.146 2.564 . . . . 0.0 112.911 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.0 153.35 52.16 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 123.535 2.823 . . . . 0.0 113.448 173.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -66.0 149.12 86.29 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.337 2.692 . . . . 0.0 112.521 177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -71.67 155.37 40.57 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.145 0.978 . . . . 0.0 113.105 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.1 p-10 -92.28 19.31 7.17 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.238 1.815 . . . . 0.0 113.664 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 54.1 mt -64.35 138.13 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.504 1.521 . . . . 0.0 109.685 171.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.6 m -131.94 129.9 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.029 1.331 . . . . 0.0 112.399 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -76.35 141.61 41.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.123 0.969 . . . . 0.0 111.264 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.87 156.11 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.753 1.621 . . . . 0.0 111.512 -177.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.89 121.58 41.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.669 1.188 . . . . 0.0 109.786 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.9 mt -109.68 125.42 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.224 1.01 . . . . 0.0 110.474 -170.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -81.55 148.28 29.23 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.167 1.387 . . . . 0.0 113.375 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -155.89 142.9 13.6 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.108 1.763 . . . . 0.0 110.093 168.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -60.56 140.14 89.67 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.756 2.304 . . . . 0.0 113.823 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.58 12.84 70.69 Favored Glycine 0 CA--C 1.539 1.577 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.96 153.58 48.2 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.173 1.389 . . . . 0.0 112.611 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -69.59 150.07 96.86 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.492 0.717 . . . . 0.0 110.936 169.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -59.66 131.07 38.11 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.39 2.06 . . . . 0.0 113.332 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -80.05 114.51 19.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.721 1.209 . . . . 0.0 110.429 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.36 129.96 35.59 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.282 0.633 . . . . 0.0 109.706 169.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 23.9 ptm -154.68 177.13 11.58 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.117 0.967 . . . . 0.0 111.689 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -119.3 124.03 45.67 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.23 1.012 . . . . 0.0 111.211 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.7 mt -90.72 110.06 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 125.531 1.532 . . . . 0.0 108.575 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.1 t0 -83.33 118.3 23.59 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.731 0.813 . . . . 0.0 109.774 169.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -65.47 -12.33 51.59 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.12 -25.19 29.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.597 1.089 . . . . 0.0 113.716 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -78.29 148.76 74.82 Favored Pre-proline 0 N--CA 1.48 1.042 0 C-N-CA 124.455 1.102 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.44 141.75 47.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.888 2.392 . . . . 0.0 110.963 173.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -61.49 -30.96 70.94 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 123.107 0.563 . . . . 0.0 112.293 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -59.45 -43.96 93.06 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.038 0.836 . . . . 0.0 112.53 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.76 81.4 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.944 -0.472 . . . . 0.0 111.985 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.06 -48.43 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.33 0.652 . . . . 0.0 110.432 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.39 -38.87 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.619 1.168 . . . . 0.0 111.051 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -59.68 -40.19 87.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.502 0.721 . . . . 0.0 112.174 171.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -71.72 -24.76 61.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.454 1.102 . . . . 0.0 113.618 174.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 23.1 t -68.93 -62.22 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.727 1.149 . . . . 0.0 110.615 169.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.1 p -64.66 -33.64 76.43 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.81 0.844 . . . . 0.0 112.659 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.76 -28.67 68.9 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.827 0.851 . . . . 0.0 112.873 172.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.79 -23.16 68.92 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.333 0.968 . . . . 0.0 114.163 174.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -114.18 12.07 17.68 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.94 1.696 . . . . 0.0 113.296 172.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.0 m 54.88 27.68 9.39 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.982 1.713 . . . . 0.0 114.479 -175.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.4 mt -76.81 127.49 32.85 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.133 1.373 . . . . 0.0 110.57 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.52 164.17 25.64 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.686 1.194 . . . . 0.0 113.462 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 53.64 68.23 0.88 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.313 1.845 . . . . 0.0 113.64 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -60.73 -21.95 63.49 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.072 -1.017 . . . . 0.0 113.496 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -54.98 -28.32 50.81 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 112.923 171.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -77.3 -18.33 57.6 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.399 1.08 . . . . 0.0 113.027 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -98.07 158.74 15.37 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -168.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.03 154.51 42.59 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.702 2.401 . . . . 0.0 110.061 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -87.3 150.49 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.42 0.629 . . . . 0.0 109.851 168.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -137.14 143.44 42.47 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.411 1.884 . . . . 0.0 109.181 -176.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -75.59 125.81 29.76 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.225 0.61 . . . . 0.0 110.543 171.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -98.2 -31.32 12.15 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.775 0.83 . . . . 0.0 113.205 178.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -70.32 -39.89 74.49 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -176.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.6 t -162.21 176.04 11.04 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.801 1.64 . . . . 0.0 111.111 -178.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.6 p 62.49 -34.21 0.11 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 129.659 3.184 . . . . 0.0 118.506 174.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . 0.286 0.7 OUTLIER 48.85 32.4 3.71 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 126.616 1.966 . . . . 0.0 114.434 -169.728 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -76.95 122.96 25.61 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.696 0.799 . . . . 0.0 111.771 171.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -61.58 142.22 57.25 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.875 -0.515 . . . . 0.0 110.014 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 mm -76.32 135.65 26.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.664 0.745 . . . . 0.0 110.797 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.4 p -143.3 173.7 11.37 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.586 2.355 . . . . 0.0 109.136 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -57.08 -22.53 40.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -90.0 -52.89 4.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.436 . . . . 0.0 112.161 169.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.7 -17.04 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -171.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.31 -28.08 40.0 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.521 1.128 . . . . 0.0 113.665 169.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -72.48 -15.93 61.8 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.203 1.001 . . . . 0.0 113.442 177.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.83 -14.14 59.42 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.902 0.881 . . . . 0.0 112.945 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.3 mt -74.8 134.0 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 124.556 1.143 . . . . 0.0 110.016 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 168.02 14.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.713 2.005 . . . . 0.0 112.28 174.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.76 123.76 18.43 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.69 -0.631 . . . . 0.0 111.176 174.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.53 34.15 36.57 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.1 0.857 . . . . 0.0 114.084 -172.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.0 m -79.06 132.45 36.62 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.168 1.484 . . . . 0.0 110.716 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mt -86.44 113.21 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.6 mt -109.0 177.18 4.84 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.123 1.769 . . . . 0.0 110.869 176.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.6 ttt85 -145.64 137.93 25.6 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.56 1.944 . . . . 0.0 110.294 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 tp -82.69 136.98 34.59 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.557 0.743 . . . . 0.0 110.06 171.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.8 t -156.84 152.32 26.7 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.049 0.94 . . . . 0.0 110.834 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.7 p -72.14 135.29 46.14 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.714 -1.241 . . . . 0.0 110.976 172.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 48.1 t -69.12 142.97 93.55 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 125.322 1.449 . . . . 0.0 113.554 -170.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -58.86 -17.59 37.55 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.472 2.781 . . . . 0.0 114.214 168.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.51 -14.46 58.86 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.041 1.336 . . . . 0.0 114.532 174.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.6 tm0? -68.02 -35.56 78.49 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -169.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.38 134.43 52.52 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.718 1.207 . . . . 0.0 112.467 175.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -153.33 162.25 41.49 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.482 1.513 . . . . 0.0 111.602 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -69.28 127.44 33.08 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.582 0.753 . . . . 0.0 111.47 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -82.97 49.0 1.44 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.406 1.482 . . . . 0.0 112.853 -174.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 68.0 mt -70.08 -35.4 74.17 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.733 1.213 . . . . 0.0 113.817 -172.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -147.66 164.83 32.28 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.945 1.698 . . . . 0.0 112.156 -172.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -144.57 141.03 29.16 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.429 1.492 . . . . 0.0 110.915 175.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 35.8 ttp-105 -79.43 64.25 4.27 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.973 1.309 . . . . 0.0 112.192 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 43.7 pt -64.73 -9.72 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.525 1.53 . . . . 0.0 114.388 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -62.44 -12.59 22.68 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.352 1.461 . . . . 0.0 113.76 177.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 89.1 p -63.37 -20.95 65.97 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.399 1.08 . . . . 0.0 113.558 170.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 89.3 p -68.19 -39.14 82.58 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.107 0.963 . . . . 0.0 113.028 176.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.2 t -164.99 133.53 3.34 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.837 1.655 . . . . 0.0 111.109 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 tpt -71.3 -36.43 71.64 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.835 0.854 . . . . 0.0 112.692 178.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -159.01 111.15 2.18 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.307 1.443 . . . . 0.0 110.902 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.82 101.71 5.21 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.919 0.888 . . . . 0.0 111.792 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -68.32 147.91 51.48 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.436 1.094 . . . . 0.0 111.659 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.1 mt -71.85 -31.01 66.06 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.701 0.801 . . . . 0.0 113.041 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.6 mp0 -141.37 155.61 45.9 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.777 2.031 . . . . 0.0 110.739 172.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.86 107.45 4.03 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.447 0.699 . . . . 0.0 110.878 173.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.2 pp -85.03 148.61 26.08 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.193 1.397 . . . . 0.0 112.81 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.54 160.29 36.5 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.468 1.907 . . . . 0.0 111.599 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 52.8 p-10 -136.67 11.02 3.17 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.463 1.505 . . . . 0.0 113.839 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -69.73 130.03 41.23 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.013 1.325 . . . . 0.0 111.173 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -147.34 162.41 39.02 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.557 1.543 . . . . 0.0 111.81 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 92.3 p -151.45 160.32 43.78 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.188 1.395 . . . . 0.0 112.277 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 63.4 tp -70.75 -34.21 71.62 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.394 1.078 . . . . 0.0 113.087 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 84.5 p -158.64 163.23 37.1 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.479 1.512 . . . . 0.0 112.249 -175.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -68.47 152.29 45.61 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.799 1.24 . . . . 0.0 112.374 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.097 1.759 . . . . 0.0 113.222 174.339 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 ttp -150.67 141.5 14.75 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 125.316 1.446 . . . . 0.0 111.057 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.74 151.7 74.77 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.158 2.572 . . . . 0.0 113.89 176.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -69.12 161.18 46.88 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.301 2.667 . . . . 0.0 112.233 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.18 146.86 93.14 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.304 2.669 . . . . 0.0 113.544 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.29 -6.17 58.6 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -82.17 32.6 0.39 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.34 2.256 . . . . 0.0 113.801 -173.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.3 mt -119.44 136.12 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 124.903 1.281 . . . . 0.0 111.324 -169.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.0 m -133.41 132.46 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.701 1.6 . . . . 0.0 112.068 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -75.74 138.43 41.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.305 1.042 . . . . 0.0 111.306 175.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m -139.92 157.56 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.351 1.461 . . . . 0.0 111.949 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -111.8 143.58 42.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.811 1.244 . . . . 0.0 109.708 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.6 mt -130.07 125.1 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.761 0.824 . . . . 0.0 110.622 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -86.63 144.81 26.99 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.587 1.555 . . . . 0.0 112.898 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -154.72 142.8 14.27 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 125.815 1.646 . . . . 0.0 110.415 169.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.34 140.28 75.98 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.733 2.288 . . . . 0.0 113.51 -174.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.77 14.08 69.74 Favored Glycine 0 CA--C 1.539 1.534 0 N-CA-C 115.31 0.884 . . . . 0.0 115.31 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.45 156.62 48.36 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.274 1.429 . . . . 0.0 112.805 -177.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -69.08 150.96 97.37 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.918 0.887 . . . . 0.0 111.396 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.17 125.88 18.08 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.792 2.328 . . . . 0.0 111.914 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -83.65 114.83 21.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.89 0.876 . . . . 0.0 110.523 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.6 mt -81.81 134.49 35.43 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.859 0.864 . . . . 0.0 109.815 169.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ppp? -158.36 178.98 9.57 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.575 1.15 . . . . 0.0 111.607 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -124.88 119.75 29.7 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.414 1.086 . . . . 0.0 111.309 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.1 mt -86.11 114.01 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 125.115 1.366 . . . . 0.0 109.085 174.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -88.8 117.24 27.64 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.004 0.922 . . . . 0.0 109.108 168.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -66.43 -14.47 62.22 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -88.12 -17.38 31.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.944 1.297 . . . . 0.0 113.906 172.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -79.32 147.01 67.82 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-N 119.628 1.103 . . . . 0.0 111.462 172.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.35 141.48 51.62 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.823 2.349 . . . . 0.0 111.086 175.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.96 -30.71 70.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.944 -0.551 . . . . 0.0 112.212 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m -59.92 -43.56 94.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.187 0.903 . . . . 0.0 112.734 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -39.32 79.71 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.793 -0.567 . . . . 0.0 111.975 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 83.8 mt -63.63 -48.45 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.503 0.721 . . . . 0.0 110.438 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.1 mt -61.58 -38.49 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.334 1.053 . . . . 0.0 110.768 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.06 -42.6 90.71 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 119.066 0.848 . . . . 0.0 112.146 170.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -69.01 -30.07 68.38 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.364 1.066 . . . . 0.0 112.974 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.49 -53.51 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 121.46 -0.775 . . . . 0.0 110.612 169.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -60.83 -43.49 98.19 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.776 0.83 . . . . 0.0 112.072 -176.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.88 -29.93 69.85 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.074 0.949 . . . . 0.0 112.891 175.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.99 -23.93 64.29 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.365 0.984 . . . . 0.0 114.295 174.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.4 m0 -115.57 14.21 16.51 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.907 1.683 . . . . 0.0 113.234 172.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.85 28.09 11.93 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.056 1.742 . . . . 0.0 114.346 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.1 mt -74.25 122.99 23.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.029 1.331 . . . . 0.0 111.283 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.56 164.56 26.44 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.489 1.116 . . . . 0.0 112.336 172.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.2 m120 54.85 50.58 15.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.243 1.417 . . . . 0.0 113.59 173.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -57.42 -20.69 31.73 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.151 0.98 . . . . 0.0 113.385 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -54.99 -28.83 54.97 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.229 1.412 . . . . 0.0 113.072 171.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -78.9 -16.45 57.01 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.222 1.009 . . . . 0.0 112.989 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -92.78 159.26 15.48 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.76 148.87 34.63 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.089 2.156 . . . . 0.0 110.202 171.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.0 mt -81.5 153.19 26.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.462 0.648 . . . . 0.0 109.586 167.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -150.56 150.28 31.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.495 . . . . 0.0 109.331 -170.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -74.78 134.69 41.77 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.945 -1.097 . . . . 0.0 112.082 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.34 40.21 0.48 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.516 1.127 . . . . 0.0 112.392 173.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -145.15 174.45 11.05 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.295 1.838 . . . . 0.0 111.413 -172.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.7 m -58.12 146.68 32.5 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.805 1.242 . . . . 0.0 112.257 174.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.4 m 64.08 115.11 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 127.089 2.156 . . . . 0.0 113.008 -169.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 -78.78 58.28 2.28 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.1 1.36 . . . . 0.0 113.658 -170.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -65.43 97.71 0.31 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.337 1.055 . . . . 0.0 112.479 174.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -64.89 139.69 58.79 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.612 -0.68 . . . . 0.0 109.772 168.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.3 mm -80.08 131.03 35.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.652 0.739 . . . . 0.0 110.711 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 45.5 p -148.39 171.76 15.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.214 2.206 . . . . 0.0 109.321 -173.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.79 -21.54 60.96 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.905 -1.122 . . . . 0.0 113.288 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -84.02 -28.07 27.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.472 1.509 . . . . 0.0 113.564 173.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -109.53 -21.25 12.55 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -170.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.07 -25.15 65.16 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -173.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -62.66 -22.4 66.42 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.693 1.197 . . . . 0.0 113.298 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -74.48 -14.66 60.85 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.913 0.885 . . . . 0.0 113.033 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 69.7 mt -73.26 132.74 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.475 1.11 . . . . 0.0 109.876 174.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -125.8 169.78 12.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.28 1.832 . . . . 0.0 112.283 174.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -58.99 128.22 36.12 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.742 -0.599 . . . . 0.0 111.08 173.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.88 8.76 78.88 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.93 1.252 . . . . 0.0 115.417 -175.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.9 m -64.83 133.57 52.21 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 119.643 1.722 . . . . 0.0 111.179 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.3 mt -95.32 121.33 45.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.576 0.75 . . . . 0.0 109.194 170.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.5 mt -113.25 175.2 5.55 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.846 2.058 . . . . 0.0 110.555 177.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -139.07 148.7 43.68 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.295 1.838 . . . . 0.0 110.257 169.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.7 tp -89.68 139.53 30.47 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.47 1.108 . . . . 0.0 110.327 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.66 154.41 28.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.206 1.002 . . . . 0.0 110.823 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 29.1 p -73.16 136.7 44.82 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.768 -1.208 . . . . 0.0 110.76 169.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 29.3 t -66.28 141.38 97.25 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 125.057 1.343 . . . . 0.0 112.167 -174.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -62.52 -20.02 69.41 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 122.712 2.275 . . . . 0.0 112.684 172.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -84.89 -12.19 53.98 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -7.94 30.55 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 -169.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -133.01 9.33 4.13 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.376 1.471 . . . . 0.0 112.69 174.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.15 165.56 13.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.2 1.4 . . . . 0.0 113.141 -177.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -67.04 156.02 37.15 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.245 1.018 . . . . 0.0 110.776 168.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -57.25 121.33 9.87 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.215 1.006 . . . . 0.0 111.285 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -76.46 -39.78 52.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.813 0.845 . . . . 0.0 113.27 -170.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -164.07 166.44 21.36 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.061 1.744 . . . . 0.0 111.367 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -152.61 141.01 20.64 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.825 1.25 . . . . 0.0 111.014 170.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.83 92.16 3.94 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.929 1.692 . . . . 0.0 109.6 177.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 81.7 mt -67.91 139.21 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.726 0.81 . . . . 0.0 109.703 176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -81.25 41.35 0.6 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.911 1.284 . . . . 0.0 112.87 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 75.6 p -78.17 -21.61 49.92 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.208 1.403 . . . . 0.0 113.953 -176.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 39.3 p -68.98 121.06 15.86 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.922 1.289 . . . . 0.0 111.924 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 28.4 t -160.35 158.8 30.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.656 1.582 . . . . 0.0 111.396 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.3 tpt -150.77 131.46 14.01 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.316 1.446 . . . . 0.0 111.177 177.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 57.2 p-10 -141.34 -3.17 1.2 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.218 1.407 . . . . 0.0 114.163 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.96 4.7 32.41 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.098 1.359 . . . . 0.0 114.162 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -64.42 139.7 58.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.189 1.396 . . . . 0.0 112.35 -174.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -73.99 46.23 0.23 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.191 2.196 . . . . 0.0 114.386 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -59.7 140.39 56.49 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.744 1.218 . . . . 0.0 113.182 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -154.86 163.32 40.45 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.996 1.719 . . . . 0.0 111.572 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.8 mt -133.29 151.35 51.89 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.716 1.606 . . . . 0.0 111.589 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.5 mtpp -72.42 152.03 42.24 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.81 1.244 . . . . 0.0 111.845 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -70.53 139.25 51.52 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.571 0.748 . . . . 0.0 111.812 172.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 69.4 tp -76.1 120.65 21.68 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.009 0.924 . . . . 0.0 111.266 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -73.11 133.39 44.12 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.508 0.723 . . . . 0.0 111.425 171.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.7 t -160.33 151.0 18.61 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.857 1.263 . . . . 0.0 111.643 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -145.22 -0.65 0.87 Allowed 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.5 p -69.74 119.58 14.2 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 121.157 -0.965 . . . . 0.0 111.418 -178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.9 mmp_? 55.34 27.91 10.63 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 126.073 1.749 . . . . 0.0 114.124 -176.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.5 t0 . . . . . 0 C--O 1.254 1.312 0 C-N-CA 125.923 1.689 . . . . 0.0 113.128 177.765 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.536 0 N-CA-C 111.837 -0.505 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptp -67.13 150.58 97.84 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 124.015 0.926 . . . . 0.0 112.618 178.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.65 154.12 74.24 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 123.027 2.485 . . . . 0.0 112.064 173.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.64 152.69 74.41 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 123.313 2.676 . . . . 0.0 112.452 177.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.18 141.48 52.48 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.213 2.609 . . . . 0.0 111.633 175.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.94 143.07 37.95 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.033 0.933 . . . . 0.0 112.7 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -121.99 16.3 10.84 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.967 1.707 . . . . 0.0 112.859 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mt -66.65 139.75 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 125.889 1.675 . . . . 0.0 111.452 -171.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.61 131.59 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.622 1.569 . . . . 0.0 112.272 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -79.08 137.81 37.68 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.734 1.214 . . . . 0.0 110.886 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.43 160.17 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.89 1.676 . . . . 0.0 112.341 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.41 116.95 26.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.261 . . . . 0.0 110.356 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.2 mt -105.1 126.49 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.911 0.885 . . . . 0.0 111.007 -171.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -84.02 142.31 30.56 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.848 1.659 . . . . 0.0 112.849 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -155.27 142.58 13.81 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 125.918 1.687 . . . . 0.0 110.424 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.21 145.53 93.41 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.708 2.272 . . . . 0.0 114.008 -175.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.14 12.25 71.73 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.508 0.963 . . . . 0.0 115.508 177.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.5 158.08 43.93 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.279 1.431 . . . . 0.0 112.536 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -70.06 155.21 93.83 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 123.84 0.856 . . . . 0.0 111.52 169.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -59.48 130.0 33.66 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.814 2.342 . . . . 0.0 112.698 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -80.19 106.71 12.4 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.024 0.93 . . . . 0.0 109.982 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 60.4 mt -76.05 125.16 28.61 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.625 0.77 . . . . 0.0 109.401 169.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -153.95 178.26 10.12 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -114.91 125.75 54.0 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.154 0.982 . . . . 0.0 111.152 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.3 mt -88.43 108.58 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 170.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -80.87 114.21 19.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.095 0.558 . . . . 0.0 109.774 169.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -68.29 -11.24 59.11 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -76.81 -34.65 57.91 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.373 0.988 . . . . 0.0 112.802 169.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -76.97 145.13 73.36 Favored Pre-proline 0 N--CA 1.481 1.075 0 C-N-CA 125.283 1.433 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.86 142.87 64.54 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.046 2.497 . . . . 0.0 111.17 175.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -59.1 -32.94 70.27 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-O 118.545 -0.74 . . . . 0.0 112.29 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.41 -41.52 85.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.64 1.109 . . . . 0.0 112.563 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.97 72.69 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.072 0.549 . . . . 0.0 112.254 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.67 -46.73 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.195 0.598 . . . . 0.0 110.332 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.4 mt -60.42 -38.57 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 125.043 1.337 . . . . 0.0 110.935 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -57.05 -46.92 82.07 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.246 0.93 . . . . 0.0 111.565 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -67.22 -28.57 68.18 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.509 1.124 . . . . 0.0 113.324 177.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.79 -52.33 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.523 1.056 . . . . 0.0 110.023 169.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.5 m -61.8 -44.27 97.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.901 0.881 . . . . 0.0 111.793 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -59.11 -29.21 67.21 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.12 1.368 . . . . 0.0 112.905 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.07 -23.47 66.02 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.401 1.0 . . . . 0.0 114.469 173.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -117.33 13.7 14.59 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.032 1.733 . . . . 0.0 113.23 172.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t 55.52 28.53 11.89 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.115 1.766 . . . . 0.0 114.351 -176.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.5 mt -74.21 125.29 28.07 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.314 1.446 . . . . 0.0 111.458 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.68 163.61 27.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.53 1.132 . . . . 0.0 112.516 174.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 54.25 53.29 11.17 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.637 1.575 . . . . 0.0 113.89 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 -58.26 -18.11 24.22 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.171 0.988 . . . . 0.0 113.562 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -55.84 -28.84 58.34 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.986 1.315 . . . . 0.0 113.008 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -79.68 -15.84 56.83 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.03 0.932 . . . . 0.0 112.771 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -94.43 159.27 15.18 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.625 1.202 . . . . 0.0 114.11 -169.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.32 151.24 36.26 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.396 2.278 . . . . 0.0 110.105 173.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.0 mt -82.33 156.64 24.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 166.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -148.87 150.08 32.37 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.649 1.18 . . . . 0.0 110.496 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -67.2 147.24 53.32 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.608 -0.682 . . . . 0.0 112.795 173.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.34 -22.49 0.91 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.678 1.191 . . . . 0.0 113.857 173.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -64.07 -41.18 97.43 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.397 0.999 . . . . 0.0 112.792 175.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.2 t -155.84 128.57 7.9 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.588 1.555 . . . . 0.0 109.881 173.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.5 t 57.9 179.91 0.06 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.283 1.433 . . . . 0.0 113.681 -169.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -130.54 38.13 3.77 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.824 2.05 . . . . 0.0 112.027 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -61.19 133.28 55.78 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.309 -0.87 . . . . 0.0 111.076 171.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -69.8 142.18 53.2 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.971 -0.456 . . . . 0.0 110.623 170.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 41.6 mm -81.51 134.21 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.228 1.011 . . . . 0.0 110.307 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -143.95 168.9 18.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.271 1.828 . . . . 0.0 109.661 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.21 -13.5 28.38 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.685 -1.259 . . . . 0.0 113.213 174.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -99.07 -6.75 27.86 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.633 1.973 . . . . 0.0 114.282 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.58 -15.97 4.39 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.094 1.358 . . . . 0.0 113.969 -173.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.95 -19.53 62.84 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -62.31 -22.51 66.11 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.843 1.257 . . . . 0.0 112.838 173.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -75.56 -13.45 60.35 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.108 0.963 . . . . 0.0 113.253 176.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.92 131.26 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.184 0.994 . . . . 0.0 109.603 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -124.61 169.85 11.52 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.912 1.685 . . . . 0.0 111.791 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -57.13 126.1 25.68 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 111.278 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.22 11.06 76.63 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.075 1.322 . . . . 0.0 115.445 -176.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.3 m -67.26 128.8 37.75 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.626 1.713 . . . . 0.0 111.405 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -83.36 126.23 40.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 169.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.7 mt -121.47 175.56 6.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.678 1.991 . . . . 0.0 110.867 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 73.8 ttt-85 -137.53 133.53 34.63 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 127.364 2.266 . . . . 0.0 110.033 176.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.5 tp -81.86 137.48 35.23 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 167.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.0 t -157.08 152.76 26.84 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.134 0.574 . . . . 0.0 111.239 -175.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.1 p -70.62 138.94 51.22 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.131 -0.981 . . . . 0.0 109.304 167.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.5 t -64.17 152.4 88.16 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 126.022 1.729 . . . . 0.0 112.003 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -72.39 -17.67 26.95 Favored 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 123.043 2.495 . . . . 0.0 112.775 168.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -110.4 -39.58 4.9 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.386 1.474 . . . . 0.0 113.656 -177.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 56.08 32.17 19.53 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.958 1.703 . . . . 0.0 113.82 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -147.51 158.59 44.06 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.907 1.683 . . . . 0.0 111.285 -174.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.24 156.19 36.94 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.638 1.175 . . . . 0.0 113.383 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -147.92 141.86 25.86 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.071 1.748 . . . . 0.0 109.866 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -125.97 -8.69 6.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.045 1.338 . . . . 0.0 114.526 -175.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.2 mp -78.77 94.07 5.07 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.003 0.921 . . . . 0.0 110.534 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -139.0 164.65 29.19 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.924 1.689 . . . . 0.0 112.023 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -112.44 151.85 29.38 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.273 1.429 . . . . 0.0 111.276 174.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -61.93 128.86 38.21 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.933 1.293 . . . . 0.0 111.53 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 89.0 mt -74.9 120.07 23.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.662 0.785 . . . . 0.0 109.037 173.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -146.84 31.19 0.95 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.003 1.321 . . . . 0.0 111.559 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 16.5 m -66.25 154.25 40.39 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.477 1.511 . . . . 0.0 113.232 -176.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 75.7 p -72.87 -8.02 53.61 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.159 1.383 . . . . 0.0 114.668 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.0 t 65.88 160.84 0.14 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.314 2.246 . . . . 0.0 114.745 -175.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -79.86 160.31 26.11 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.685 1.194 . . . . 0.0 113.307 -174.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -128.44 32.71 4.8 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.695 1.598 . . . . 0.0 111.675 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.64 -3.67 45.15 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.371 1.468 . . . . 0.0 114.707 -174.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -65.39 145.74 55.78 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.699 1.2 . . . . 0.0 111.664 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 95.1 mt -129.15 174.41 9.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.384 1.874 . . . . 0.0 110.785 174.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -146.49 32.72 0.96 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.985 1.314 . . . . 0.0 112.441 172.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.51 147.15 53.89 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.733 1.213 . . . . 0.0 112.334 174.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.9 mt -140.41 160.37 40.15 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.845 1.658 . . . . 0.0 111.879 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -143.15 -36.1 0.38 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.444 1.498 . . . . 0.0 113.093 176.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -150.48 154.09 37.05 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.773 1.629 . . . . 0.0 110.776 175.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 97.8 mt -130.31 -2.75 4.41 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.809 2.044 . . . . 0.0 113.143 179.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -72.03 -15.87 62.04 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.8 m -63.67 146.04 54.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.11 1.364 . . . . 0.0 113.081 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 96.5 mt -135.84 152.61 51.23 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.98 1.712 . . . . 0.0 111.471 178.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.8 m -143.35 155.83 44.53 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.625 1.57 . . . . 0.0 111.954 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.11 154.21 42.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.468 1.107 . . . . 0.0 112.015 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.0 t0 . . . . . 0 C--O 1.254 1.307 0 C-N-CA 126.119 1.768 . . . . 0.0 111.945 179.792 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.9 mtp -69.24 149.72 97.41 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.159 0.983 . . . . 0.0 112.458 177.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -67.24 157.34 62.22 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 123.443 2.762 . . . . 0.0 112.557 175.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -67.18 154.15 75.2 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.262 2.641 . . . . 0.0 112.374 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.44 64.18 7.25 Favored 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 124.779 3.653 . . . . 0.0 112.507 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 58.2 34.04 23.74 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 126.434 1.894 . . . . 0.0 115.019 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -75.68 9.69 2.15 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.9 mt -132.77 134.97 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.634 1.574 . . . . 0.0 109.589 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 m -134.36 132.45 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.349 1.46 . . . . 0.0 111.489 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -77.16 144.09 38.62 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.53 155.19 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 125.922 1.689 . . . . 0.0 111.391 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.9 112.95 21.02 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.563 1.145 . . . . 0.0 110.331 175.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.2 mt -102.52 126.4 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.909 0.884 . . . . 0.0 111.075 -169.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -82.24 146.87 29.26 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.14 1.776 . . . . 0.0 113.215 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -154.25 141.39 13.45 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 125.854 1.662 . . . . 0.0 110.232 168.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.54 138.1 73.58 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.664 2.243 . . . . 0.0 113.463 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.07 12.77 72.15 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.309 0.883 . . . . 0.0 115.309 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.85 152.96 50.85 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.222 1.409 . . . . 0.0 112.641 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -68.99 150.67 97.54 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 123.898 0.879 . . . . 0.0 111.072 170.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.37 129.68 30.78 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.471 2.114 . . . . 0.0 113.179 -179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -80.57 110.75 16.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.608 1.163 . . . . 0.0 110.36 176.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.3 mt -77.33 126.54 31.09 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.487 0.715 . . . . 0.0 109.818 169.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.0 ptm -155.02 177.46 11.3 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.291 1.036 . . . . 0.0 111.555 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -112.74 136.07 52.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.962 0.905 . . . . 0.0 112.6 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.8 mt -96.78 109.49 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 125.563 1.545 . . . . 0.0 107.914 169.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -84.56 116.84 23.36 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -66.98 -11.78 57.86 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -86.62 -22.54 26.13 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.747 1.219 . . . . 0.0 113.63 170.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -82.12 142.82 48.14 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.324 1.05 . . . . 0.0 111.57 175.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.57 144.9 68.39 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.403 2.736 . . . . 0.0 111.621 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.5 mt -60.33 -32.67 71.46 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.084 176.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 m -58.85 -42.9 90.43 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.418 1.008 . . . . 0.0 112.583 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.56 -39.4 77.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.067 0.547 . . . . 0.0 111.981 174.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.46 -46.35 95.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.523 0.729 . . . . 0.0 110.687 176.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.8 mt -60.84 -38.24 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.93 1.292 . . . . 0.0 111.281 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.04 -38.7 89.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.4 0.68 . . . . 0.0 112.251 171.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.34 -24.74 62.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.235 1.014 . . . . 0.0 113.195 173.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.6 t -69.87 -58.04 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 119.604 1.093 . . . . 0.0 110.704 169.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 15.3 p -63.74 -33.52 75.83 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.502 0.721 . . . . 0.0 112.654 -169.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -61.43 -26.98 68.23 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.58 1.152 . . . . 0.0 113.045 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.36 -22.86 71.48 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.279 0.942 . . . . 0.0 114.225 174.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -119.03 11.81 12.56 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.985 1.714 . . . . 0.0 113.27 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 m 54.5 29.92 12.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.025 1.73 . . . . 0.0 114.376 -175.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.9 mt -77.6 127.03 31.8 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.542 1.137 . . . . 0.0 110.445 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.18 160.6 27.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.522 1.129 . . . . 0.0 113.445 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 51.55 69.11 0.7 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.774 2.03 . . . . 0.0 113.261 170.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -60.56 -18.83 55.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.546 1.138 . . . . 0.0 113.72 -176.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -54.75 -28.28 47.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.227 1.411 . . . . 0.0 112.933 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -78.29 -17.93 55.95 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.859 0.863 . . . . 0.0 113.204 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -99.21 158.58 15.59 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -168.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.79 149.83 33.09 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.597 1.959 . . . . 0.0 110.256 171.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.4 mt -76.56 154.67 34.28 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.445 0.64 . . . . 0.0 109.43 167.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -148.58 156.58 42.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.279 1.831 . . . . 0.0 108.808 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 -66.34 150.66 48.53 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.74 -1.225 . . . . 0.0 111.984 170.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.14 -11.35 60.9 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 178.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -61.19 168.36 2.61 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.549 1.539 . . . . 0.0 112.797 172.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.9 m -66.4 -36.07 81.91 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.524 1.129 . . . . 0.0 113.509 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.1 t -74.16 147.29 42.76 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.869 0.868 . . . . 0.0 112.867 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -80.8 50.58 1.37 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.976 1.311 . . . . 0.0 114.343 -170.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -71.28 74.17 0.7 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.55 1.14 . . . . 0.0 112.279 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -59.3 135.48 57.66 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.805 0.842 . . . . 0.0 110.713 171.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.4 mm -80.71 134.35 27.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 123.942 0.897 . . . . 0.0 110.586 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -131.78 163.1 28.95 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.38 1.872 . . . . 0.0 111.029 -176.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -61.7 -16.24 47.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -86.04 -52.68 5.54 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.938 1.295 . . . . 0.0 112.693 169.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -86.67 -12.24 48.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -169.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.8 ptm180 -54.64 -23.42 17.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.972 1.309 . . . . 0.0 114.269 173.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -65.35 -18.61 65.45 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.11 1.364 . . . . 0.0 113.363 175.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -80.59 -12.68 59.48 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 113.533 173.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -71.0 134.26 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.902 0.881 . . . . 0.0 109.776 175.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -121.38 165.26 15.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.501 1.52 . . . . 0.0 112.219 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -60.53 123.16 16.55 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.001 0.52 . . . . 0.0 110.985 177.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.43 11.0 63.08 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.259 1.409 . . . . 0.0 115.476 -174.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.3 m -66.15 129.71 40.73 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.729 1.765 . . . . 0.0 110.973 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.2 mt -85.11 125.18 40.39 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.7 mt -119.06 -179.42 3.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.682 1.993 . . . . 0.0 110.714 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.5 ttp-105 -145.89 135.47 23.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 127.637 2.375 . . . . 0.0 110.09 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.5 tp -84.45 138.25 32.92 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.592 0.757 . . . . 0.0 109.827 169.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.2 t -160.15 155.55 25.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.996 0.918 . . . . 0.0 110.369 -177.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.0 p -70.33 148.82 48.02 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.743 -1.223 . . . . 0.0 111.183 170.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.5 p -62.14 159.38 38.93 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 124.77 1.228 . . . . 0.0 113.916 -171.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.54 -23.43 57.37 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 122.291 1.994 . . . . 0.0 112.829 176.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.53 -39.81 57.83 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.419 1.088 . . . . 0.0 112.374 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -66.7 -34.13 77.17 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.567 -0.708 . . . . 0.0 112.358 174.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -77.93 -5.7 51.99 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.311 1.044 . . . . 0.0 113.795 171.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . 60.05 -26.59 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 130.043 3.337 . . . . 0.0 117.856 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -76.67 -16.91 59.41 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.693 1.597 . . . . 0.0 113.652 -174.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 47.68 46.26 18.09 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.52 1.928 . . . . 0.0 115.213 170.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.453 ' H ' HD22 ' A' ' 88' ' ' LEU . 2.3 mm? -61.68 143.69 55.75 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.423 1.089 . . . . 0.0 111.944 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -138.16 -11.83 1.45 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.096 1.358 . . . . 0.0 113.313 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -70.73 115.03 9.41 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.75 2.02 . . . . 0.0 111.159 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -64.74 129.55 40.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.978 0.911 . . . . 0.0 111.327 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 71.6 mt -82.87 113.65 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 123.53 0.732 . . . . 0.0 109.41 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -78.54 -23.56 46.13 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.382 1.073 . . . . 0.0 113.363 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 29.2 t -69.49 143.16 53.58 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.393 1.077 . . . . 0.0 112.858 -178.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.7 t -154.62 141.2 18.88 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.485 1.514 . . . . 0.0 111.204 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.6 t -77.62 -40.72 41.03 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.013 0.925 . . . . 0.0 113.451 -176.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 46.3 ttp -157.64 154.95 29.23 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.188 1.395 . . . . 0.0 111.621 -174.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -64.32 -14.83 58.44 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -175.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -143.71 150.23 38.36 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.84 1.656 . . . . 0.0 110.957 173.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -99.13 138.71 35.84 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.738 1.215 . . . . 0.0 111.697 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.8 mp -137.93 148.63 45.45 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.827 1.651 . . . . 0.0 110.825 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -142.81 149.87 39.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.781 1.632 . . . . 0.0 111.3 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.14 143.89 47.13 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.724 0.809 . . . . 0.0 112.526 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.0 mt -125.1 19.55 8.31 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.738 1.615 . . . . 0.0 112.834 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -66.81 148.67 51.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.164 1.386 . . . . 0.0 112.213 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.9 133.06 48.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.841 0.856 . . . . 0.0 112.11 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.89 145.64 36.09 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.129 0.972 . . . . 0.0 111.716 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -70.87 141.96 51.21 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.796 0.838 . . . . 0.0 112.241 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.6 t -159.96 157.98 29.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.28 1.432 . . . . 0.0 111.617 178.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 98.3 mt -132.27 106.96 8.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.838 1.655 . . . . 0.0 110.046 175.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 18.5 m -79.99 -15.06 58.02 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -176.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 95.8 mtm-85 -73.33 152.04 41.05 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.146 1.378 . . . . 0.0 112.819 -177.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 . . . . . 0 C--O 1.255 1.343 0 C-N-CA 127.426 2.29 . . . . 0.0 114.319 177.755 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 112.143 -0.383 . . . . 0.0 112.143 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -66.48 150.31 97.36 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.095 0.958 . . . . 0.0 112.658 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.05 157.13 63.16 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.202 2.601 . . . . 0.0 112.512 175.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.73 155.86 68.56 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 123.475 2.783 . . . . 0.0 112.424 175.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -66.87 148.79 82.87 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.428 2.752 . . . . 0.0 112.716 178.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.06 164.65 26.3 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.626 1.17 . . . . 0.0 112.944 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -77.29 63.87 2.58 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.759 1.624 . . . . 0.0 112.371 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.9 mt -108.05 137.39 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.347 1.459 . . . . 0.0 111.114 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.3 m -133.11 135.05 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.636 1.574 . . . . 0.0 111.928 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -76.11 142.52 41.66 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.078 0.951 . . . . 0.0 111.676 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.7 m -142.34 157.31 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.563 1.545 . . . . 0.0 111.889 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.06 123.09 43.62 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.869 1.268 . . . . 0.0 110.029 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -111.09 126.09 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.02 0.928 . . . . 0.0 110.836 -170.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -83.54 142.23 31.03 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.033 1.733 . . . . 0.0 112.733 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -155.06 142.72 14.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.89 1.676 . . . . 0.0 110.535 170.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.32 142.98 88.03 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.681 2.254 . . . . 0.0 113.78 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.05 13.83 70.23 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 177.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.0 157.45 45.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.198 1.399 . . . . 0.0 112.645 -176.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -69.05 152.46 96.77 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.826 0.85 . . . . 0.0 111.411 170.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -60.33 128.4 26.07 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.737 2.291 . . . . 0.0 112.36 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -81.25 111.22 17.46 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.939 0.895 . . . . 0.0 110.283 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -78.32 128.69 34.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.579 0.752 . . . . 0.0 109.592 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.1 ptm -154.99 178.59 10.02 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.706 0.802 . . . . 0.0 112.418 174.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 -112.08 129.74 56.12 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.791 1.237 . . . . 0.0 111.481 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.9 mt -97.76 111.76 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 125.259 1.424 . . . . 0.0 108.362 170.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -85.95 117.36 24.75 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.966 -0.754 . . . . 0.0 108.966 169.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -66.24 -14.76 62.45 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -80.78 -30.81 35.96 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.139 1.375 . . . . 0.0 113.664 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -73.55 143.22 82.0 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 124.188 0.995 . . . . 0.0 111.377 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.85 142.39 62.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.015 2.477 . . . . 0.0 111.108 177.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -59.36 -32.43 70.11 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.539 -0.744 . . . . 0.0 112.173 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m -58.51 -41.86 86.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.624 1.102 . . . . 0.0 112.76 176.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.78 -40.9 72.31 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.064 0.546 . . . . 0.0 112.127 175.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.61 -46.09 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.399 0.68 . . . . 0.0 110.533 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.36 -37.34 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.826 1.251 . . . . 0.0 110.969 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -61.26 -41.94 97.78 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.477 1.035 . . . . 0.0 112.243 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -66.84 -28.51 68.41 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.392 1.077 . . . . 0.0 112.959 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.0 -54.29 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.374 0.988 . . . . 0.0 110.177 168.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -61.22 -41.77 97.44 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.222 1.009 . . . . 0.0 112.137 -174.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.05 -29.85 68.8 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.142 0.977 . . . . 0.0 112.925 175.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.91 -23.35 65.59 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.348 0.975 . . . . 0.0 114.403 174.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -117.54 14.41 14.53 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.982 1.713 . . . . 0.0 113.177 172.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.67 28.58 12.28 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.099 1.76 . . . . 0.0 114.337 -177.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.6 mt -74.79 127.36 32.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.17 1.388 . . . . 0.0 111.622 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.63 165.51 24.18 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.689 1.196 . . . . 0.0 112.461 173.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 53.96 54.77 9.24 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.558 1.543 . . . . 0.0 113.629 173.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -58.31 -21.2 48.31 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.928 0.891 . . . . 0.0 112.987 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -56.61 -28.14 59.75 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.548 1.539 . . . . 0.0 112.827 175.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -80.63 -17.5 51.08 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.967 0.907 . . . . 0.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -90.77 159.9 16.07 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.539 1.162 . . . . 0.0 113.869 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.24 151.27 37.31 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.789 2.436 . . . . 0.0 109.828 172.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.7 mt -82.92 158.61 22.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 166.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -149.4 145.64 27.06 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 124.648 1.179 . . . . 0.0 110.494 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.0 m-70 -68.26 129.08 38.84 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.67 -0.644 . . . . 0.0 110.996 171.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -89.43 -6.02 56.89 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -146.43 161.19 40.95 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.301 1.44 . . . . 0.0 111.812 -175.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.8 m 63.15 -47.39 0.22 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 128.699 2.799 . . . . 0.0 115.453 -172.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.5 t -160.4 149.16 16.93 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.639 1.576 . . . . 0.0 111.205 170.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -78.99 36.45 0.28 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.502 1.521 . . . . 0.0 114.028 -175.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -63.19 127.41 31.14 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.873 -1.142 . . . . 0.0 112.305 -178.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -70.28 143.12 52.18 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.133 0.573 . . . . 0.0 110.377 169.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mm -83.82 133.86 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.77 1.228 . . . . 0.0 110.549 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.3 p -144.55 165.73 27.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 127.005 2.122 . . . . 0.0 110.178 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.19 -11.91 17.13 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 121.041 -1.037 . . . . 0.0 113.344 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -90.46 -20.96 22.13 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.765 1.626 . . . . 0.0 114.585 176.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -135.51 -2.41 2.45 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -173.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.49 -22.16 12.08 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 175.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -62.59 -18.49 62.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.172 1.389 . . . . 0.0 113.415 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -73.38 -14.72 61.33 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.5 mt -72.87 128.82 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.92 0.888 . . . . 0.0 109.601 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -120.13 174.56 6.41 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.112 1.765 . . . . 0.0 112.246 172.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -57.52 130.46 46.42 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.907 -0.495 . . . . 0.0 111.24 170.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.56 10.93 83.77 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 124.71 1.148 . . . . 0.0 115.367 -177.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 90.3 m -65.67 129.65 40.5 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.618 1.709 . . . . 0.0 110.967 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 35.1 mt -86.28 122.07 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 170.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.3 mt -118.57 174.66 6.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.155 1.782 . . . . 0.0 111.082 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.2 ttt-85 -138.57 135.07 34.63 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 127.338 2.255 . . . . 0.0 109.851 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -83.24 136.66 34.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.048 0.539 . . . . 0.0 109.651 168.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.1 t -158.26 149.26 20.78 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.776 0.83 . . . . 0.0 110.82 -174.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.6 p -71.54 132.97 45.45 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.655 -1.278 . . . . 0.0 110.627 170.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.8 t -61.56 142.21 94.34 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 125.125 1.37 . . . . 0.0 112.196 -176.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -65.14 -14.05 43.07 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.965 2.443 . . . . 0.0 112.906 172.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 10.81 28.91 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.292 1.837 . . . . 0.0 114.035 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.38 151.4 28.05 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.241 -0.912 . . . . 0.0 113.448 -177.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.69 161.5 37.1 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.425 1.49 . . . . 0.0 110.802 177.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.13 145.85 55.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.295 0.638 . . . . 0.0 111.513 170.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -69.04 122.61 19.06 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.734 0.814 . . . . 0.0 111.446 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -91.26 -16.04 28.22 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -169.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.0 tp -144.82 -48.75 0.25 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -174.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 45.3 m170 -86.61 40.71 0.91 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.26 1.424 . . . . 0.0 112.661 -176.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -74.59 74.23 1.99 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.669 1.588 . . . . 0.0 113.381 -170.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 36.6 ttp85 56.43 28.24 13.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 127.143 2.177 . . . . 0.0 115.617 169.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -64.13 128.95 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.018 0.927 . . . . 0.0 110.535 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -83.71 45.37 1.06 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.44 1.496 . . . . 0.0 112.726 -177.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 78.9 p -74.93 -20.91 59.49 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.134 1.374 . . . . 0.0 114.172 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 31.0 t -69.66 129.54 39.91 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.291 1.036 . . . . 0.0 112.02 179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 38.9 m -72.24 146.5 47.23 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.628 1.171 . . . . 0.0 113.267 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.9 ptm -70.79 162.07 29.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.986 0.915 . . . . 0.0 112.085 169.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -68.17 131.14 44.87 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.666 -0.646 . . . . 0.0 111.658 172.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -76.9 148.16 36.6 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.987 0.915 . . . . 0.0 112.609 177.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -73.74 149.98 41.45 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.474 1.11 . . . . 0.0 111.626 172.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.1 mt -72.99 149.6 43.16 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.012 0.925 . . . . 0.0 111.735 174.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -143.38 157.13 44.71 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.586 1.554 . . . . 0.0 111.933 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.15 157.55 35.11 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.091 0.956 . . . . 0.0 112.622 173.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.94 136.95 56.14 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.889 0.875 . . . . 0.0 111.904 178.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.2 mmtm -141.09 26.29 2.03 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.558 1.943 . . . . 0.0 112.354 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -75.29 -21.67 58.3 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.988 1.315 . . . . 0.0 113.484 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 60.4 tp -67.98 134.8 51.34 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.798 1.239 . . . . 0.0 111.533 174.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -150.25 166.13 30.87 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.309 1.444 . . . . 0.0 112.045 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.2 t -150.37 137.2 19.17 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.287 1.435 . . . . 0.0 110.89 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 94.8 mt -136.31 156.87 48.03 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.937 1.695 . . . . 0.0 111.824 -176.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.6 t -62.96 -18.32 63.04 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -69.85 -25.09 63.57 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.972 1.709 . . . . 0.0 113.543 173.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.402 1.481 . . . . 0.0 114.042 -174.397 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.645 0 N-CA-C 111.806 -0.517 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.9 mtm -69.13 147.83 97.58 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 123.856 0.863 . . . . 0.0 112.295 177.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -61.22 147.97 94.17 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 123.097 2.531 . . . . 0.0 113.61 176.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.37 156.44 61.75 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 123.338 2.692 . . . . 0.0 112.131 173.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -67.0 144.45 70.04 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.139 2.559 . . . . 0.0 111.937 174.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.86 152.42 33.38 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.957 0.903 . . . . 0.0 112.615 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -79.91 51.25 1.3 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.025 1.33 . . . . 0.0 112.204 175.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.1 mt -127.66 136.33 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.329 1.452 . . . . 0.0 109.973 -172.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.7 m -133.2 131.71 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.23 1.412 . . . . 0.0 111.945 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -77.46 138.58 39.33 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.957 0.903 . . . . 0.0 111.168 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -137.47 157.07 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.7 1.6 . . . . 0.0 111.62 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.91 132.4 55.33 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.266 1.026 . . . . 0.0 109.886 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.0 mt -121.28 123.55 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.042 0.937 . . . . 0.0 110.628 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -82.46 143.85 30.86 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.151 1.381 . . . . 0.0 112.899 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -156.09 143.8 14.07 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.915 1.686 . . . . 0.0 110.161 169.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -62.77 144.98 94.71 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.665 2.243 . . . . 0.0 113.918 -175.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.0 11.48 74.46 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.82 155.66 44.21 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.192 1.397 . . . . 0.0 112.585 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -70.09 152.53 95.77 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 123.507 0.723 . . . . 0.0 110.955 169.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -59.21 130.76 37.59 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.45 2.1 . . . . 0.0 113.408 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -78.47 118.09 20.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.726 1.21 . . . . 0.0 110.488 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.1 131.48 35.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.292 0.637 . . . . 0.0 109.404 168.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.8 ptm -155.73 176.71 12.26 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.145 0.978 . . . . 0.0 111.644 172.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -115.31 129.82 56.72 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.149 0.98 . . . . 0.0 111.745 176.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.8 mt -95.44 112.36 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 125.8 1.64 . . . . 0.0 108.504 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -86.32 116.99 24.84 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.353 1.061 . . . . 0.0 109.966 171.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -68.2 -13.36 62.18 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -78.76 -31.03 46.02 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.338 0.972 . . . . 0.0 113.184 169.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -77.03 144.88 72.73 Favored Pre-proline 0 N--CA 1.48 1.034 0 C-N-CA 123.984 0.914 . . . . 0.0 112.042 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.2 143.26 70.43 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.124 2.55 . . . . 0.0 111.214 175.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.34 -30.28 69.43 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.117 -0.944 . . . . 0.0 112.672 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.1 t -57.97 -47.14 83.84 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.246 1.385 . . . . 0.0 112.097 173.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.62 -40.34 95.32 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.63 -0.669 . . . . 0.0 112.13 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 94.3 mt -67.1 -45.93 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.672 0.789 . . . . 0.0 110.815 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.8 mt -61.36 -35.82 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.646 1.179 . . . . 0.0 110.645 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 tttp -62.55 -41.16 98.72 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.12 0.873 . . . . 0.0 112.394 171.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -65.37 -30.44 71.27 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.234 1.014 . . . . 0.0 113.101 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.59 -54.52 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 119.375 0.989 . . . . 0.0 110.247 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.3 m -61.36 -42.47 98.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.444 1.098 . . . . 0.0 112.089 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -60.2 -29.53 68.78 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.11 0.964 . . . . 0.0 112.859 175.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.61 -23.37 64.97 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.49 1.043 . . . . 0.0 114.364 174.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.57 16.09 14.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.939 1.696 . . . . 0.0 113.14 172.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.9 p 56.19 21.21 5.06 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.241 2.217 . . . . 0.0 115.505 -176.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.35 126.86 30.94 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.428 1.491 . . . . 0.0 111.649 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.87 164.33 24.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.697 1.199 . . . . 0.0 112.388 173.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 52.98 62.01 2.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.74 1.616 . . . . 0.0 113.464 173.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -61.17 -19.19 61.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.807 0.843 . . . . 0.0 112.808 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -53.25 -30.14 36.57 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.005 1.722 . . . . 0.0 113.198 170.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -76.69 -14.84 59.92 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.142 0.977 . . . . 0.0 113.046 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -102.38 158.55 16.12 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.886 1.275 . . . . 0.0 114.247 -168.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.77 150.97 39.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.258 2.223 . . . . 0.0 109.852 169.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.93 154.58 26.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 166.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -145.11 143.71 30.53 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.516 1.126 . . . . 0.0 109.896 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.7 m-70 -66.15 145.03 56.28 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.659 -0.651 . . . . 0.0 111.699 174.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.63 -18.93 2.13 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -178.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.8 p30 -85.54 2.96 42.68 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.957 1.466 . . . . 0.0 114.957 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.1 t -146.31 -63.24 0.31 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.091 0.957 . . . . 0.0 112.726 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -158.65 161.46 37.16 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.19 1.396 . . . . 0.0 110.984 175.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -74.54 43.53 0.19 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.767 2.027 . . . . 0.0 115.02 -169.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -67.97 125.83 27.54 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 120.716 -1.24 . . . . 0.0 111.08 174.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -68.08 142.31 55.86 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.492 -0.755 . . . . 0.0 111.388 172.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -80.99 137.53 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.1 0.96 . . . . 0.0 110.109 174.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 15.5 p -144.28 168.43 20.07 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.507 1.923 . . . . 0.0 109.447 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -63.78 -4.19 2.97 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 177.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -118.89 -15.61 9.34 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.389 1.476 . . . . 0.0 114.662 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -90.12 -22.71 21.64 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.86 1.209 . . . . 0.0 113.633 173.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -59.4 -19.82 50.16 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -173.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -63.64 -24.61 67.86 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.332 1.053 . . . . 0.0 113.056 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -74.83 -16.08 60.71 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.834 0.854 . . . . 0.0 113.097 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.6 mt -71.06 133.33 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.102 0.961 . . . . 0.0 109.841 173.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -129.7 171.37 12.72 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.364 1.865 . . . . 0.0 111.328 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -60.24 121.32 11.66 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.911 -0.493 . . . . 0.0 110.312 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.16 8.56 81.61 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.849 1.214 . . . . 0.0 115.459 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.3 m -63.38 130.72 45.64 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.893 1.847 . . . . 0.0 110.564 173.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mt -91.65 123.61 43.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 123.351 0.66 . . . . 0.0 109.425 173.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -114.96 174.27 6.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.556 1.942 . . . . 0.0 110.943 177.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -137.49 136.05 37.36 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 127.082 2.153 . . . . 0.0 109.745 173.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.0 tp -79.47 136.72 37.0 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.25 0.62 . . . . 0.0 110.009 169.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.6 t -155.07 147.53 24.07 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.564 0.746 . . . . 0.0 111.036 -176.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -71.23 130.62 41.89 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.879 -1.138 . . . . 0.0 110.532 171.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.7 p -73.6 157.59 87.45 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.231 1.412 . . . . 0.0 114.371 -168.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -69.98 -20.64 33.53 Favored 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 122.505 2.136 . . . . 0.0 112.12 169.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.27 4.79 8.06 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.904 1.681 . . . . 0.0 114.882 179.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.36 -36.86 81.36 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.773 -1.204 . . . . 0.0 112.879 172.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -76.78 -40.11 49.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.791 0.836 . . . . 0.0 113.085 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -158.57 158.4 33.86 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.067 1.747 . . . . 0.0 110.756 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -71.89 74.94 0.89 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.818 1.247 . . . . 0.0 112.24 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -71.63 -21.69 61.8 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.911 1.684 . . . . 0.0 114.11 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.5 mt -67.22 152.57 45.5 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.041 1.336 . . . . 0.0 112.879 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -68.88 163.39 24.44 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.153 1.381 . . . . 0.0 112.999 175.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -68.87 122.43 18.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.686 0.794 . . . . 0.0 111.249 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.1 82.98 6.06 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.128 0.971 . . . . 0.0 111.483 -175.448 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.7 pt -62.9 148.15 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.918 0.887 . . . . 0.0 111.782 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -82.37 -25.2 34.02 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.679 0.791 . . . . 0.0 112.652 173.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.4 m -68.28 139.83 55.97 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.908 1.283 . . . . 0.0 112.865 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 24.7 t -76.43 161.61 28.53 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.189 0.996 . . . . 0.0 112.084 171.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.8 m -73.28 59.85 0.58 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.692 1.597 . . . . 0.0 111.341 169.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.6 ptm -80.73 5.25 16.32 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.442 1.897 . . . . 0.0 115.539 -169.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 49.5 p-10 -68.7 -12.19 61.11 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -148.86 142.95 25.93 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.393 1.877 . . . . 0.0 110.515 169.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -155.03 146.86 23.41 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.623 1.169 . . . . 0.0 112.625 -176.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.4 tp -145.07 126.29 14.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.77 2.028 . . . . 0.0 108.603 168.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -71.6 -49.48 39.91 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -164.71 161.21 20.54 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.903 1.681 . . . . 0.0 111.736 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.0 mt -75.22 154.95 37.32 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.939 0.896 . . . . 0.0 110.649 168.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -64.52 146.22 54.92 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 113.21 0.818 . . . . 0.0 113.21 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.1 p-10 -92.24 -17.8 24.31 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.344 1.458 . . . . 0.0 112.932 169.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 81.0 mt -71.46 146.54 48.56 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.965 1.306 . . . . 0.0 112.267 177.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.76 150.0 49.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.442 0.697 . . . . 0.0 111.733 172.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.2 m -75.57 -11.04 59.94 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 87.5 mt -71.92 146.16 48.0 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.003 1.321 . . . . 0.0 111.969 174.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 29.3 t -65.46 -21.85 66.69 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.279 1.032 . . . . 0.0 113.616 177.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -64.82 -30.35 71.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.825 1.65 . . . . 0.0 114.219 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 51.2 t0 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 125.23 1.412 . . . . 0.0 113.18 -178.742 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.602 0 N-CA-C 111.931 -0.468 . . . . 0.0 111.931 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.8 mmm -70.32 155.85 92.79 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 123.95 0.9 . . . . 0.0 112.706 177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -60.84 161.47 21.68 Favored 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 123.499 2.799 . . . . 0.0 113.987 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -58.03 151.15 60.0 Favored 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 123.645 2.897 . . . . 0.0 113.659 175.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -68.64 151.67 74.86 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.442 2.762 . . . . 0.0 112.569 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.72 37.06 0.17 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.713 1.605 . . . . 0.0 114.183 -178.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -78.73 45.16 0.58 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.35 1.86 . . . . 0.0 113.05 -176.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 mt -128.41 135.66 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 125.098 1.359 . . . . 0.0 110.51 -170.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -134.37 133.33 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.434 1.494 . . . . 0.0 111.883 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -75.05 142.15 43.78 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.121 0.969 . . . . 0.0 110.767 174.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m -141.55 156.77 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.807 1.643 . . . . 0.0 111.223 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.75 124.77 50.44 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.376 1.07 . . . . 0.0 110.269 171.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mt -112.46 123.76 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.334 1.054 . . . . 0.0 110.761 -170.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -79.55 144.34 34.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 112.817 174.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -154.65 143.29 14.65 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.777 1.631 . . . . 0.0 110.359 169.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -63.88 142.1 80.73 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.592 2.195 . . . . 0.0 113.6 -173.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.52 70.94 Favored Glycine 0 CA--C 1.539 1.533 0 N-CA-C 115.378 0.911 . . . . 0.0 115.378 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.16 154.91 46.1 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.259 1.424 . . . . 0.0 112.558 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -70.15 151.71 95.91 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 123.692 0.797 . . . . 0.0 111.177 169.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -59.43 130.64 36.6 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.502 2.135 . . . . 0.0 113.377 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -80.22 117.9 21.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.544 1.137 . . . . 0.0 110.637 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt -79.73 130.84 35.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 168.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.5 ptm -154.57 179.51 8.97 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.296 1.038 . . . . 0.0 111.226 171.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -122.25 125.74 46.7 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.137 0.975 . . . . 0.0 111.753 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.4 mt -89.78 116.74 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 C-N-CA 125.638 1.575 . . . . 0.0 108.932 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -89.9 113.25 24.83 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.088 1.355 . . . . 0.0 109.715 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -69.61 -11.7 61.05 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -88.97 -15.99 32.84 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.51 1.124 . . . . 0.0 113.79 170.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -79.06 149.04 72.73 Favored Pre-proline 0 N--CA 1.481 1.103 0 CA-C-N 119.831 1.196 . . . . 0.0 112.203 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.48 146.25 84.64 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.899 2.4 . . . . 0.0 110.984 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 mt -63.49 -27.94 69.62 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 118.529 -0.748 . . . . 0.0 112.264 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.5 t -59.0 -45.99 89.29 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.663 1.119 . . . . 0.0 112.423 171.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.48 99.25 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.584 -0.697 . . . . 0.0 112.078 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 53.3 mt -65.18 -49.02 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.595 0.758 . . . . 0.0 110.877 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.7 mt -61.74 -36.31 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.122 0.969 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.31 -43.62 92.63 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.114 0.87 . . . . 0.0 112.21 170.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -66.94 -27.53 67.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.362 1.065 . . . . 0.0 113.079 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 16.0 t -68.37 -57.48 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 CA-C-N 119.576 1.08 . . . . 0.0 110.358 169.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.6 m -60.98 -40.86 95.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.259 1.024 . . . . 0.0 112.522 -173.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -61.12 -27.66 68.54 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.45 -23.68 68.71 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.391 0.996 . . . . 0.0 114.413 174.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -116.27 16.03 15.85 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.802 1.641 . . . . 0.0 113.146 172.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 m 55.22 26.6 8.62 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.977 1.711 . . . . 0.0 114.557 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.2 mt -73.57 125.33 27.73 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.079 1.352 . . . . 0.0 111.164 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.6 155.7 37.55 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.404 1.081 . . . . 0.0 112.507 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 49.46 71.6 0.37 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.62 1.968 . . . . 0.0 113.144 173.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 -60.85 -16.99 47.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.472 1.109 . . . . 0.0 112.944 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -52.07 -29.36 21.07 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.155 1.782 . . . . 0.0 113.101 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -75.51 -15.24 60.42 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.12 160.74 14.6 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -167.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.68 150.21 38.37 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.995 2.118 . . . . 0.0 110.127 169.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.05 154.48 28.11 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 166.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -147.43 147.13 29.9 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.676 1.19 . . . . 0.0 110.456 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 -67.98 132.87 48.1 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.448 -0.783 . . . . 0.0 110.945 171.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.94 -19.22 60.75 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -65.58 166.24 10.93 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.717 1.207 . . . . 0.0 112.659 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.8 p -60.76 -16.28 38.6 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.085 1.354 . . . . 0.0 114.611 -176.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 79.4 p -62.29 -31.96 72.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.074 1.35 . . . . 0.0 113.232 170.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 51.6 30.86 7.0 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.157 1.783 . . . . 0.0 114.547 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -64.75 127.4 31.4 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 120.885 -1.135 . . . . 0.0 111.819 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -68.3 141.96 55.69 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.943 -0.473 . . . . 0.0 110.453 169.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 40.2 mm -78.08 132.26 32.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.884 0.874 . . . . 0.0 110.443 176.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.5 p -139.4 164.94 28.53 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 111.232 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -63.75 -6.76 6.13 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.802 1.241 . . . . 0.0 113.608 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -107.31 -8.08 16.49 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.169 1.788 . . . . 0.0 114.021 176.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -134.02 -5.28 2.74 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -55.9 -23.81 33.68 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -62.05 -21.72 65.15 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.251 1.42 . . . . 0.0 113.272 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -74.63 -14.17 60.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.012 0.925 . . . . 0.0 112.999 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.2 mt -71.55 130.61 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.046 0.938 . . . . 0.0 109.428 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -123.08 168.89 11.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.093 1.757 . . . . 0.0 112.255 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -60.86 123.41 17.46 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.768 -0.583 . . . . 0.0 110.942 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.71 11.3 64.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.268 1.413 . . . . 0.0 115.557 -174.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.2 m -65.73 131.87 47.37 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.704 1.752 . . . . 0.0 111.058 176.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mt -87.27 121.65 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -118.28 178.79 4.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.597 1.959 . . . . 0.0 110.551 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -144.44 136.32 26.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 126.759 2.023 . . . . 0.0 109.936 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.7 tp -82.77 138.15 34.12 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.131 0.572 . . . . 0.0 109.885 169.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.3 t -154.77 151.3 28.52 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.996 0.918 . . . . 0.0 110.409 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.4 p -68.9 131.81 45.7 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.89 -1.131 . . . . 0.0 110.396 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.8 t -62.08 153.42 74.09 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.808 2.043 . . . . 0.0 112.79 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -71.91 -16.45 29.3 Favored 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 122.945 2.43 . . . . 0.0 113.091 168.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -114.72 -32.15 5.92 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.524 1.53 . . . . 0.0 114.02 -177.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 56.29 -148.69 0.48 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.73 1.612 . . . . 0.0 113.001 172.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -63.28 -13.21 35.88 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -177.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -77.95 -9.86 59.3 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 171.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 42.5 tp60 -63.72 120.46 11.87 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.427 1.091 . . . . 0.0 111.873 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -82.03 -39.44 23.52 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -176.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 77.5 mt -101.15 134.61 43.91 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.425 1.49 . . . . 0.0 112.695 -172.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -137.25 22.78 2.99 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.531 1.933 . . . . 0.0 111.868 -177.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.52 156.41 38.04 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.098 2.559 . . . . 0.0 109.793 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 16.0 tpt85 -76.35 98.19 4.45 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.259 -0.9 . . . . 0.0 110.279 175.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 49.6 mm -70.82 106.06 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.917 0.887 . . . . 0.0 109.842 174.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -160.92 163.26 32.02 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.607 1.963 . . . . 0.0 110.99 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 46.9 t -74.17 -42.04 60.52 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.883 0.873 . . . . 0.0 111.156 169.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 28.2 t -76.75 166.33 23.51 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.202 1.401 . . . . 0.0 112.108 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.8 m -64.46 -30.48 71.52 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.133 -0.979 . . . . 0.0 112.749 170.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -160.04 157.55 28.86 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.908 1.683 . . . . 0.0 111.5 175.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 46.3 p-10 -132.37 -4.3 3.4 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.049 1.339 . . . . 0.0 114.559 -178.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 130.75 43.9 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.664 1.186 . . . . 0.0 112.993 -175.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -164.12 164.76 22.7 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.997 2.119 . . . . 0.0 111.2 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.5 pp -72.96 -23.52 60.67 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -173.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -79.02 157.82 28.01 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.21 1.004 . . . . 0.0 112.814 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.2 133.41 52.8 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.614 0.766 . . . . 0.0 112.265 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 70.1 mt -88.81 159.38 17.77 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.879 1.272 . . . . 0.0 112.458 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -147.73 145.13 28.73 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.79 1.636 . . . . 0.0 111.008 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -69.28 157.02 37.8 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.163 0.985 . . . . 0.0 112.761 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 86.8 mt -71.16 143.52 50.5 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.694 1.198 . . . . 0.0 112.223 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -72.98 -20.87 60.94 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 94.4 p -155.8 165.4 36.62 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.186 1.794 . . . . 0.0 111.181 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 94.6 mt -131.01 153.96 48.69 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.392 1.477 . . . . 0.0 111.779 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.0 m -74.04 -3.54 29.99 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.251 1.42 . . . . 0.0 114.798 -178.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -143.66 143.87 31.64 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.37 1.868 . . . . 0.0 111.027 -177.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 . . . . . 0 C--O 1.253 1.248 0 C-N-CA 126.279 1.832 . . . . 0.0 113.404 177.281 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt -66.64 141.23 96.84 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.186 0.995 . . . . 0.0 112.034 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -58.79 154.07 46.08 Favored 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.401 2.734 . . . . 0.0 114.185 175.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.18 158.33 55.27 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.56 2.84 . . . . 0.0 112.857 176.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -65.61 156.92 61.23 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.596 2.864 . . . . 0.0 113.053 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -150.78 175.01 12.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.881 1.672 . . . . 0.0 111.623 -177.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -75.86 55.51 0.89 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.43 1.492 . . . . 0.0 112.406 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.7 mt -133.18 136.89 54.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 126.329 1.852 . . . . 0.0 109.418 -172.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.4 m -132.51 131.87 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.988 1.315 . . . . 0.0 111.646 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.22 143.6 47.07 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.738 0.815 . . . . 0.0 110.635 172.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m -139.65 150.67 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.983 1.713 . . . . 0.0 110.988 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.37 109.54 19.23 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.558 1.143 . . . . 0.0 109.751 173.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.8 mt -99.8 124.59 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 123.848 0.859 . . . . 0.0 109.988 -173.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -93.29 149.37 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.254 1.422 . . . . 0.0 112.612 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -153.18 142.89 15.04 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.957 1.703 . . . . 0.0 110.276 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -59.99 138.9 85.01 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.698 2.265 . . . . 0.0 113.77 -175.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.85 12.8 75.08 Favored Glycine 0 CA--C 1.539 1.584 0 N-CA-C 115.436 0.934 . . . . 0.0 115.436 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.41 156.84 47.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.195 1.398 . . . . 0.0 112.912 -177.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -72.38 155.55 91.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 124.368 1.067 . . . . 0.0 111.15 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -65.89 129.26 21.61 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.554 2.169 . . . . 0.0 112.06 -177.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -79.42 106.05 11.17 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.321 1.448 . . . . 0.0 109.853 174.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.6 mt -75.38 126.89 31.92 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.338 0.655 . . . . 0.0 109.453 169.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.0 ptm -153.13 177.76 10.47 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.213 1.005 . . . . 0.0 111.462 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -117.06 129.93 56.33 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.002 0.921 . . . . 0.0 112.023 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.0 mt -92.39 109.28 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.343 1.457 . . . . 0.0 108.462 170.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -83.98 119.56 25.06 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -66.65 -11.18 52.75 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -176.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -86.76 -23.56 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.011 1.324 . . . . 0.0 113.856 171.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -78.56 141.31 60.5 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.454 1.024 . . . . 0.0 111.372 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.71 144.28 59.27 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.278 2.652 . . . . 0.0 111.628 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.71 -31.01 71.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.377 -0.82 . . . . 0.0 112.762 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -59.18 -46.83 87.39 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.874 1.215 . . . . 0.0 111.98 174.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.6 -39.64 91.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.589 -0.694 . . . . 0.0 112.329 176.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.81 -48.67 85.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.491 0.716 . . . . 0.0 110.513 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -62.7 -37.1 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.71 1.204 . . . . 0.0 110.977 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.53 -39.72 84.86 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.545 0.738 . . . . 0.0 112.038 170.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -73.26 -24.73 60.49 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.711 1.204 . . . . 0.0 113.762 173.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 32.3 t -69.31 -61.23 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.644 1.111 . . . . 0.0 110.587 169.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.8 p -64.08 -34.32 77.77 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.797 0.839 . . . . 0.0 112.624 -170.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.71 -29.24 69.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.879 0.872 . . . . 0.0 112.906 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.79 -23.54 67.4 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.406 1.003 . . . . 0.0 114.171 174.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -115.0 11.53 16.51 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.71 . . . . 0.0 113.288 172.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.65 29.34 13.48 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.088 1.755 . . . . 0.0 114.282 -176.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.0 mt -79.1 131.23 36.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.22 1.408 . . . . 0.0 110.705 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.89 164.43 22.64 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.697 1.199 . . . . 0.0 113.623 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 53.14 68.87 0.77 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.403 1.881 . . . . 0.0 113.749 170.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -62.65 -21.01 65.37 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.229 -0.92 . . . . 0.0 113.068 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -54.78 -31.01 58.25 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.737 1.615 . . . . 0.0 113.117 171.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -77.12 -21.0 54.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.791 0.837 . . . . 0.0 112.68 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.71 158.96 15.28 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 122.731 1.253 . . . . 0.0 114.002 -169.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.9 154.07 39.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.058 2.543 . . . . 0.0 109.585 174.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 34.1 mt -86.4 154.05 21.47 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 167.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -144.92 145.76 31.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.354 1.061 . . . . 0.0 110.561 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -63.74 132.1 49.93 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 122.014 -0.429 . . . . 0.0 111.755 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -108.45 -28.84 9.13 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.842 0.857 . . . . 0.0 113.162 176.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -69.25 -36.99 77.71 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 41.6 t -160.93 151.49 18.13 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.778 1.231 . . . . 0.0 112.676 -178.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.8 m 59.75 -17.29 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 118.983 2.957 . . . . 0.0 118.983 169.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.0 m120 57.04 34.86 25.59 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.94 1.696 . . . . 0.0 115.172 173.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -67.07 136.76 55.7 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.219 -0.926 . . . . 0.0 110.733 169.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -71.67 145.11 49.1 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.085 0.554 . . . . 0.0 110.436 169.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.6 mm -83.6 135.05 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.847 0.859 . . . . 0.0 110.52 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.6 p -145.52 168.0 21.65 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.815 2.046 . . . . 0.0 109.119 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -62.0 -16.72 53.65 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 121.123 -0.985 . . . . 0.0 113.171 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -88.33 -34.56 17.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.664 1.586 . . . . 0.0 113.529 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -92.84 -25.43 18.11 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -57.27 -25.17 58.78 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -171.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -67.87 -15.3 63.56 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.354 1.062 . . . . 0.0 113.51 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -78.87 -16.19 57.37 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.5 mt -67.08 139.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.743 1.217 . . . . 0.0 110.09 175.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -126.79 161.63 27.74 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.405 1.482 . . . . 0.0 111.703 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -61.66 119.61 9.01 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.894 -0.504 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.47 10.71 60.29 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 125.333 1.444 . . . . 0.0 115.625 -174.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.9 m -63.66 132.44 51.09 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.615 1.707 . . . . 0.0 111.709 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.3 mt -86.62 125.33 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.566 0.747 . . . . 0.0 109.388 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -122.29 172.37 8.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.329 1.852 . . . . 0.0 111.156 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtm105 -131.09 143.73 50.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.531 1.932 . . . . 0.0 110.584 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.36 136.63 34.28 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 166.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.0 t -157.24 151.95 25.54 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.728 0.811 . . . . 0.0 111.044 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.8 p -72.23 136.66 46.43 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.674 -1.266 . . . . 0.0 110.846 171.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 31.4 t -63.39 145.51 97.06 Favored Pre-proline 0 CA--C 1.542 0.654 0 C-N-CA 125.516 1.527 . . . . 0.0 113.164 -173.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -63.56 -11.85 28.18 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.212 2.608 . . . . 0.0 113.525 171.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.88 -12.53 61.31 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 172.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -64.39 149.61 48.01 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.107 0.867 . . . . 0.0 112.615 177.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -69.15 157.36 37.04 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.729 1.212 . . . . 0.0 113.908 -173.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -145.91 157.95 43.88 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.033 1.733 . . . . 0.0 111.941 177.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -70.47 160.45 32.37 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -177.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -76.41 160.01 29.94 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.458 1.103 . . . . 0.0 111.495 168.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.2 mt -76.18 147.91 38.11 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.287 1.035 . . . . 0.0 112.277 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -86.83 8.1 24.29 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -68.95 159.28 33.0 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.67 1.188 . . . . 0.0 114.113 -175.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -143.01 142.39 31.58 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.502 1.921 . . . . 0.0 110.987 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 93.8 mt -72.18 110.94 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 169.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -83.64 -23.43 31.81 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 8.0 t -81.74 -178.5 7.0 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.425 1.49 . . . . 0.0 112.796 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 47.8 t -62.8 158.02 19.83 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.995 1.318 . . . . 0.0 112.485 171.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 65.2 m -71.55 -14.26 62.04 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 177.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.2 ptm -68.08 159.95 29.87 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.179 0.992 . . . . 0.0 112.927 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 52.3 p30 -145.73 179.09 7.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.117 1.367 . . . . 0.0 112.077 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.06 -3.3 31.74 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -173.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.65 144.23 55.62 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.46 1.104 . . . . 0.0 112.138 -177.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.6 mt -68.51 154.78 41.19 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.383 1.073 . . . . 0.0 112.513 178.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -77.68 47.82 0.64 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.742 1.617 . . . . 0.0 113.234 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.74 148.13 52.33 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.637 1.175 . . . . 0.0 112.514 177.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.9 mt -137.87 154.66 49.45 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.881 1.673 . . . . 0.0 111.655 -177.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -152.25 143.28 23.1 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.886 1.674 . . . . 0.0 110.915 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -84.86 106.86 16.7 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.867 0.867 . . . . 0.0 110.803 171.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 11.1 mp -83.15 -11.09 58.25 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.383 1.073 . . . . 0.0 113.593 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.65 136.49 57.03 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.049 0.94 . . . . 0.0 112.613 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.3 p -81.14 -24.66 37.47 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.633 1.173 . . . . 0.0 114.063 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.9 pp -72.16 153.72 41.47 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.585 1.154 . . . . 0.0 113.074 -178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 90.7 p -137.76 3.65 2.5 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.194 1.398 . . . . 0.0 114.206 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -70.1 163.07 27.02 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.308 1.443 . . . . 0.0 113.918 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.333 1.453 . . . . 0.0 112.831 169.571 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.59 0 N-CA-C 111.834 -0.506 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ptp -67.57 158.24 83.28 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 124.0 0.92 . . . . 0.0 112.82 177.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.97 156.79 42.1 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.264 2.643 . . . . 0.0 114.132 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -61.5 163.89 16.86 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 123.595 2.863 . . . . 0.0 114.145 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.43 156.26 26.96 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.91 3.073 . . . . 0.0 113.873 172.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.37 142.64 58.31 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 47.8 p30 -142.64 19.28 2.02 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.111 1.764 . . . . 0.0 113.19 -174.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.5 mt -125.94 137.55 57.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.072 1.749 . . . . 0.0 109.619 178.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -130.9 133.51 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.114 1.366 . . . . 0.0 112.209 -178.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -71.29 141.71 50.5 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.187 0.995 . . . . 0.0 111.518 171.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -141.28 153.05 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.46 1.504 . . . . 0.0 111.838 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.68 116.52 28.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.945 1.298 . . . . 0.0 109.966 173.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.9 mt -107.41 120.75 59.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.162 0.985 . . . . 0.0 110.607 -170.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -81.16 149.08 29.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.217 1.407 . . . . 0.0 112.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -152.53 142.88 15.26 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.798 1.639 . . . . 0.0 109.97 169.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -62.14 136.47 60.7 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.512 2.141 . . . . 0.0 113.416 -172.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.09 12.53 71.92 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 115.214 0.845 . . . . 0.0 115.214 -179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.41 154.32 50.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.098 1.359 . . . . 0.0 112.892 -177.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -68.83 153.8 95.56 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 124.433 1.093 . . . . 0.0 111.633 172.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -66.07 125.6 14.39 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.62 2.213 . . . . 0.0 111.68 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -77.74 110.64 12.77 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 110.415 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -75.94 127.09 32.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.294 0.638 . . . . 0.0 109.86 169.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 21.9 ptm -151.72 -178.0 6.45 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.259 1.024 . . . . 0.0 111.837 173.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -120.5 132.6 55.27 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.421 1.088 . . . . 0.0 112.117 176.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.3 mt -96.72 111.87 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.416 1.486 . . . . 0.0 108.836 171.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.69 115.44 20.95 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -67.23 -10.77 53.97 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -90.16 -22.55 21.67 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.743 1.217 . . . . 0.0 113.866 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -87.37 145.56 37.89 Favored Pre-proline 0 N--CA 1.482 1.152 0 CA-C-N 119.667 1.122 . . . . 0.0 111.336 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.36 146.42 56.4 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.272 2.648 . . . . 0.0 112.74 -173.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.88 -31.6 71.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.343 0.657 . . . . 0.0 112.533 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.3 m -60.27 -42.2 94.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.24 0.927 . . . . 0.0 112.471 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.07 78.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.194 0.598 . . . . 0.0 111.914 175.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.52 -49.05 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.288 0.635 . . . . 0.0 110.751 174.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 56.4 mt -61.35 -37.54 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.04 0.936 . . . . 0.0 111.146 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -59.33 -45.98 89.86 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.031 0.832 . . . . 0.0 111.974 170.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -68.89 -26.11 64.94 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.831 1.252 . . . . 0.0 113.094 177.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 67.1 t -68.01 -60.83 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 119.185 0.902 . . . . 0.0 109.505 168.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.2 m -58.02 -36.54 72.86 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.34 1.456 . . . . 0.0 113.381 -170.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -59.18 -27.9 66.12 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.194 0.998 . . . . 0.0 113.526 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.01 -27.28 73.24 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.326 -0.859 . . . . 0.0 114.205 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -106.48 13.81 27.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.454 1.502 . . . . 0.0 112.756 173.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.2 m 55.56 27.46 10.42 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.128 1.771 . . . . 0.0 114.211 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.2 mt -75.9 114.31 14.38 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.64 1.176 . . . . 0.0 110.909 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.75 162.0 30.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.357 1.063 . . . . 0.0 112.049 173.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 54.37 55.69 7.8 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.403 1.481 . . . . 0.0 113.332 176.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -57.76 -17.74 17.41 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 113.368 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -56.37 -28.58 59.62 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.11 1.364 . . . . 0.0 112.966 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -78.32 -14.86 59.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.158 0.983 . . . . 0.0 112.73 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -94.42 157.75 15.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.56 1.144 . . . . 0.0 114.054 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.51 145.65 31.14 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.13 2.172 . . . . 0.0 109.715 176.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -79.95 145.32 32.67 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.532 0.682 . . . . 0.0 109.593 168.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -134.06 146.85 50.71 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.371 1.869 . . . . 0.0 108.83 -176.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -72.69 146.45 46.49 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.466 -0.771 . . . . 0.0 112.578 176.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -129.21 -27.57 2.45 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.61 1.164 . . . . 0.0 112.325 169.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -72.86 -51.11 20.04 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.087 0.955 . . . . 0.0 111.513 169.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.9 t -85.59 -177.11 6.33 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.557 1.143 . . . . 0.0 112.354 171.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 t -63.66 170.05 3.55 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.263 1.025 . . . . 0.0 111.745 169.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -70.01 42.11 0.05 Allowed 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 127.189 2.196 . . . . 0.0 116.599 -168.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -74.4 112.85 10.98 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.877 1.271 . . . . 0.0 111.512 171.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -61.47 136.57 58.07 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.842 -0.536 . . . . 0.0 110.421 169.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.7 mm -75.11 130.11 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 123.438 0.695 . . . . 0.0 110.333 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.0 p -140.22 164.12 30.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.888 1.675 . . . . 0.0 110.845 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -60.6 -15.3 26.64 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.218 -0.926 . . . . 0.0 113.056 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -89.26 -15.03 34.52 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.078 1.751 . . . . 0.0 114.671 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -135.41 -7.21 2.25 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -174.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -57.16 -21.22 31.28 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -61.22 -21.58 63.98 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.914 1.286 . . . . 0.0 113.173 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.18 -13.97 60.5 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.201 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 80.4 mt -71.32 131.94 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.334 1.054 . . . . 0.0 109.778 174.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -116.23 170.37 8.58 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 112.507 171.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -58.79 128.58 37.92 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.912 -0.493 . . . . 0.0 111.013 169.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.1 9.46 76.84 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 124.961 1.267 . . . . 0.0 115.251 -176.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.7 m -64.96 130.19 42.48 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.546 1.673 . . . . 0.0 111.326 177.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.6 124.48 40.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.436 0.694 . . . . 0.0 109.321 170.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -122.38 177.79 5.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.991 2.116 . . . . 0.0 110.28 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -144.53 136.73 26.26 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.75 2.02 . . . . 0.0 110.019 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.0 tp -82.32 137.44 34.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.341 0.656 . . . . 0.0 109.999 169.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.5 t -157.26 159.45 37.62 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.168 0.987 . . . . 0.0 110.555 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.2 p -72.08 144.69 48.6 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.72 -1.238 . . . . 0.0 110.548 169.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.6 t -56.7 149.06 43.66 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 125.729 1.612 . . . . 0.0 113.029 -174.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -65.57 -17.86 58.02 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 122.896 2.397 . . . . 0.0 113.136 173.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -105.58 -54.71 2.44 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.933 1.293 . . . . 0.0 112.92 177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 56.52 -62.72 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 128.208 2.603 . . . . 0.0 115.623 -170.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 -83.68 150.36 25.91 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.688 1.595 . . . . 0.0 112.801 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.2 141.02 49.03 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.796 0.838 . . . . 0.0 112.506 178.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -155.64 151.05 27.0 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.563 1.545 . . . . 0.0 111.481 176.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -91.38 -33.16 15.38 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.175 1.39 . . . . 0.0 112.338 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mp -77.97 147.97 34.66 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.285 1.434 . . . . 0.0 112.292 -174.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -155.32 159.58 40.08 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.341 1.856 . . . . 0.0 110.846 174.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -157.5 169.42 24.74 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.745 1.218 . . . . 0.0 112.536 -176.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 23.2 tpp85 -61.41 143.34 56.0 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.862 1.265 . . . . 0.0 111.52 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -56.14 135.11 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.923 1.289 . . . . 0.0 111.269 -177.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -130.8 176.49 8.16 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.49 1.916 . . . . 0.0 112.465 -171.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 19.6 m -59.32 155.71 14.03 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.19 1.396 . . . . 0.0 113.281 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.2 m -73.82 43.19 0.15 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.604 1.962 . . . . 0.0 115.532 -171.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.6 t -66.46 148.11 52.34 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.622 1.169 . . . . 0.0 111.826 172.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 61.1 mtt -142.42 152.99 43.35 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.312 1.445 . . . . 0.0 112.251 -175.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -80.02 -1.41 39.64 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.755 1.222 . . . . 0.0 114.134 178.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 58.64 22.56 10.0 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.422 1.889 . . . . 0.0 114.805 -174.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -152.64 165.99 33.52 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.008 2.123 . . . . 0.0 111.556 177.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.3 tp -146.68 127.82 14.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.835 1.254 . . . . 0.0 110.657 172.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -144.36 142.64 30.51 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.628 1.571 . . . . 0.0 110.664 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -82.78 131.51 35.2 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.675 0.79 . . . . 0.0 111.544 173.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.0 pp -154.66 160.48 41.44 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.191 1.396 . . . . 0.0 112.302 176.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -132.44 158.09 42.92 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.793 1.637 . . . . 0.0 111.575 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -152.68 -57.09 0.13 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.294 1.438 . . . . 0.0 110.456 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 28.8 tp 62.5 -14.89 0.06 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 128.636 2.775 . . . . 0.0 116.706 170.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.84 143.01 55.61 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.706 1.202 . . . . 0.0 112.53 175.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 84.1 p -157.06 167.2 31.14 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.234 1.414 . . . . 0.0 111.986 -176.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.16 133.86 56.49 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.914 1.286 . . . . 0.0 112.0 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 67.1 m -67.85 148.41 51.21 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.026 0.93 . . . . 0.0 113.118 -178.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -69.73 171.31 9.32 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.935 1.294 . . . . 0.0 113.509 173.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 43.3 t0 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 126.191 1.796 . . . . 0.0 110.844 169.142 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.562 0 N-CA-C 111.972 -0.451 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.29 149.79 97.34 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.173 0.989 . . . . 0.0 112.715 178.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -67.77 159.69 51.62 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 C-N-CA 123.648 2.899 . . . . 0.0 112.911 176.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -65.24 155.37 68.87 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 123.498 2.798 . . . . 0.0 112.58 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -68.26 149.02 75.54 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 123.514 2.809 . . . . 0.0 113.113 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.87 71.12 3.38 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.187 1.395 . . . . 0.0 112.138 178.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.53 67.22 1.48 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.787 1.635 . . . . 0.0 111.205 174.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.2 mt -108.39 137.71 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.946 1.698 . . . . 0.0 110.454 -177.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -132.08 134.29 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.656 1.583 . . . . 0.0 111.413 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.1 143.03 35.93 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.02 0.928 . . . . 0.0 110.992 174.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.93 157.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.737 1.615 . . . . 0.0 111.459 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.21 115.91 26.85 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.637 1.175 . . . . 0.0 110.033 172.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.1 mt -104.65 125.16 59.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 123.833 0.853 . . . . 0.0 110.333 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -89.16 144.34 26.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.887 1.275 . . . . 0.0 112.316 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -153.79 143.99 15.59 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.104 1.762 . . . . 0.0 110.068 173.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -62.79 145.06 94.7 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.724 2.283 . . . . 0.0 113.985 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 11.34 75.08 Favored Glycine 0 CA--C 1.539 1.552 0 N-CA-C 115.484 0.954 . . . . 0.0 115.484 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.7 156.82 44.66 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.215 1.406 . . . . 0.0 112.64 -177.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -69.55 153.77 95.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 123.767 0.827 . . . . 0.0 111.314 169.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.74 128.98 28.76 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.516 2.144 . . . . 0.0 112.907 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -81.0 112.08 18.07 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.91 1.284 . . . . 0.0 110.365 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -76.64 127.5 32.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.455 0.702 . . . . 0.0 109.62 169.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -153.89 171.6 18.72 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.171 0.988 . . . . 0.0 111.538 177.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -114.85 124.54 52.0 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.796 0.838 . . . . 0.0 112.82 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.0 mt -91.6 110.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 125.705 1.602 . . . . 0.0 108.5 174.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -85.48 117.07 24.17 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.779 0.832 . . . . 0.0 109.259 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -67.23 -13.32 61.86 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -84.26 -23.14 30.51 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.613 1.165 . . . . 0.0 113.45 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -79.94 148.03 67.38 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 124.569 1.148 . . . . 0.0 111.926 177.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.58 141.25 49.78 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.748 2.299 . . . . 0.0 111.041 175.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.38 -31.63 70.53 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.002 0.521 . . . . 0.0 112.004 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -59.82 -42.64 93.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.211 0.914 . . . . 0.0 112.804 175.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.34 79.74 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.823 -0.548 . . . . 0.0 111.99 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.57 -48.18 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.669 0.787 . . . . 0.0 110.523 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -62.68 -35.76 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 124.075 0.95 . . . . 0.0 110.757 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -60.13 -44.09 95.18 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.401 1.001 . . . . 0.0 112.28 170.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -67.48 -34.02 76.31 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.421 1.088 . . . . 0.0 112.932 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.88 -53.17 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.917 0.887 . . . . 0.0 111.119 172.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 86.6 m -59.87 -42.57 94.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.819 0.848 . . . . 0.0 112.076 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.47 -27.89 68.89 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.641 0.776 . . . . 0.0 112.971 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.8 -23.64 65.67 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.457 1.027 . . . . 0.0 114.289 172.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -115.23 16.61 16.87 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.02 1.728 . . . . 0.0 113.161 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 56.29 25.14 9.0 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 126.049 1.739 . . . . 0.0 114.732 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.4 mt -75.13 122.89 24.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.236 1.414 . . . . 0.0 111.712 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 163.36 27.66 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.145 . . . . 0.0 112.168 171.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 53.06 52.95 12.77 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.454 1.501 . . . . 0.0 113.181 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 22.1 p80 -57.73 -24.76 58.53 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.146 0.979 . . . . 0.0 112.811 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -63.48 -12.71 33.96 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.321 1.448 . . . . 0.0 113.937 173.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -81.56 -17.45 48.36 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.309 -0.87 . . . . 0.0 112.739 168.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -94.98 160.96 14.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 122.637 1.208 . . . . 0.0 113.951 -169.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.66 152.51 42.51 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.721 2.409 . . . . 0.0 109.479 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.0 mt -82.81 155.59 24.11 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -143.4 144.03 31.88 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.442 1.097 . . . . 0.0 110.614 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -67.47 134.1 50.74 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 176.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.49 -32.02 8.72 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.104 0.962 . . . . 0.0 111.591 167.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -75.26 -49.17 20.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.078 0.951 . . . . 0.0 113.054 172.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -82.62 177.38 8.73 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.719 0.807 . . . . 0.0 112.12 173.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.3 t -74.95 59.42 0.91 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.155 1.782 . . . . 0.0 114.759 -169.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 59.12 21.26 9.24 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.604 1.962 . . . . 0.0 115.753 171.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -67.24 133.54 49.92 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.738 -1.227 . . . . 0.0 111.905 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -69.83 143.08 52.99 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.11 0.564 . . . . 0.0 110.056 169.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.4 mm -82.65 132.52 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.625 0.77 . . . . 0.0 110.725 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.0 p -148.9 172.3 14.91 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.244 2.217 . . . . 0.0 109.275 -174.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.58 -20.74 57.89 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.802 -1.186 . . . . 0.0 113.325 172.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.22 -18.8 23.83 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.528 1.531 . . . . 0.0 113.72 175.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -114.87 -19.27 11.06 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -174.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -61.14 -23.12 65.3 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.528 1.306 . . . . 0.0 114.528 -175.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -63.94 -22.83 67.1 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.949 1.3 . . . . 0.0 113.184 173.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -75.26 -13.6 60.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 112.864 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.1 mt -74.14 128.66 36.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.4 1.08 . . . . 0.0 109.514 172.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -113.5 173.67 6.29 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.415 1.486 . . . . 0.0 111.946 169.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -61.69 130.88 47.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.692 -0.63 . . . . 0.0 111.14 170.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.14 9.98 83.28 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 125.143 1.354 . . . . 0.0 115.646 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 88.7 m -65.95 131.74 46.96 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 119.637 1.719 . . . . 0.0 111.736 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 51.1 mt -85.34 127.73 39.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 123.574 0.75 . . . . 0.0 109.351 169.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.4 mt -124.05 171.78 9.49 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.841 2.056 . . . . 0.0 110.855 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -133.38 136.2 45.16 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 127.077 2.151 . . . . 0.0 110.229 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -82.27 137.57 34.81 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 168.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.8 t -156.76 150.09 24.25 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.776 0.83 . . . . 0.0 111.44 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.6 p -70.54 127.51 32.96 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.748 -1.22 . . . . 0.0 110.287 170.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.2 t -66.81 141.11 96.6 Favored Pre-proline 0 CA--C 1.537 0.46 0 C-N-CA 125.197 1.399 . . . . 0.0 112.703 -172.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -62.3 -25.96 76.88 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.416 2.077 . . . . 0.0 112.024 170.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -78.13 -11.92 59.95 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 176.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -14.1 62.4 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 120.29 1.404 . . . . 0.0 113.7 -178.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -64.9 -21.95 66.91 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.849 1.26 . . . . 0.0 112.907 170.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -98.93 5.64 47.15 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.728 1.611 . . . . 0.0 114.314 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -63.54 152.05 39.72 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.234 0.925 . . . . 0.0 112.874 177.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -136.81 165.24 26.4 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.912 1.685 . . . . 0.0 111.583 -176.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.1 mt -65.95 131.07 45.38 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.777 0.831 . . . . 0.0 111.856 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -158.55 165.2 35.09 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.931 1.692 . . . . 0.0 111.884 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -77.61 138.76 39.3 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.582 0.753 . . . . 0.0 112.558 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.41 138.51 41.74 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.567 1.147 . . . . 0.0 110.395 170.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -67.32 -49.8 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.763 0.825 . . . . 0.0 110.668 176.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -155.85 133.73 11.24 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.523 1.529 . . . . 0.0 110.44 171.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 39.2 m -80.92 -37.06 30.23 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.747 1.219 . . . . 0.0 113.285 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 33.8 t -160.58 155.32 23.98 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.107 1.363 . . . . 0.0 112.065 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 80.9 p -74.85 -20.33 59.8 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.38 1.072 . . . . 0.0 113.523 171.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 62.1 mtt -145.48 144.25 30.48 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.41 1.484 . . . . 0.0 112.201 -177.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -84.39 29.02 0.61 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.103 1.361 . . . . 0.0 113.361 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.81 141.77 51.34 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.721 1.209 . . . . 0.0 112.681 -177.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -78.06 140.65 39.12 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.355 1.062 . . . . 0.0 111.961 177.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.8 tp -78.59 150.19 32.8 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.752 1.221 . . . . 0.0 111.523 172.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -146.22 162.8 37.26 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.304 1.442 . . . . 0.0 111.765 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -147.79 161.26 41.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.21 1.404 . . . . 0.0 112.024 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 88.9 mt -73.13 -16.39 61.45 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -177.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.19 160.86 43.6 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.238 1.815 . . . . 0.0 112.406 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -76.2 157.87 32.24 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.424 1.09 . . . . 0.0 112.609 176.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.1 pp -69.78 -1.81 10.29 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -76.42 22.15 0.17 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.338 1.855 . . . . 0.0 114.975 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.0 m -63.41 -1.99 1.36 Allowed 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -172.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.43 -14.71 63.04 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.878 1.271 . . . . 0.0 113.195 169.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.4 p -65.73 158.57 27.19 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.721 1.208 . . . . 0.0 113.331 175.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -150.87 146.9 26.63 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.714 1.605 . . . . 0.0 111.342 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 125.226 1.41 . . . . 0.0 113.639 178.152 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.389 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptp -73.19 163.03 71.53 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 124.136 0.974 . . . . 0.0 112.304 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -57.74 149.03 71.16 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 123.238 2.625 . . . . 0.0 113.002 173.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.65 149.68 83.89 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.166 2.577 . . . . 0.0 113.256 -173.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -67.0 160.45 47.19 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.676 2.917 . . . . 0.0 111.19 171.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -152.19 153.82 34.58 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -172.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 50.51 31.34 5.47 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.338 1.855 . . . . 0.0 113.738 173.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.9 mt -60.21 133.3 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 125.197 1.399 . . . . 0.0 111.097 -174.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.9 m -134.22 131.3 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.005 1.322 . . . . 0.0 112.609 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -67.52 141.5 56.87 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.167 0.987 . . . . 0.0 110.952 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.1 m -142.03 153.55 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.797 1.239 . . . . 0.0 112.062 175.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.06 120.55 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.921 1.288 . . . . 0.0 109.602 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.0 mt -107.92 122.21 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.645 0.778 . . . . 0.0 110.593 -171.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -84.9 149.67 25.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.981 1.712 . . . . 0.0 113.187 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -156.74 142.2 12.58 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.038 1.735 . . . . 0.0 110.27 169.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -60.59 137.45 73.65 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.642 2.228 . . . . 0.0 113.506 -176.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.87 12.56 74.94 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.28 154.13 51.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.252 1.421 . . . . 0.0 112.61 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.07 152.82 92.75 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.659 0.784 . . . . 0.0 111.435 169.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -61.43 131.73 37.53 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.581 2.188 . . . . 0.0 113.063 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -82.77 109.05 16.58 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.105 0.962 . . . . 0.0 110.023 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.6 mt -74.83 132.04 41.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.41 0.684 . . . . 0.0 110.081 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ptp -154.02 179.97 8.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.218 1.007 . . . . 0.0 111.964 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -123.41 125.38 44.85 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.729 1.211 . . . . 0.0 111.338 171.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.6 mt -86.79 110.96 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 124.629 1.172 . . . . 0.0 108.891 172.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -82.99 121.59 27.2 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.152 0.981 . . . . 0.0 108.462 167.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -69.8 -10.38 58.19 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -86.38 -15.18 41.22 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.473 1.286 . . . . 0.0 114.473 169.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -87.79 140.72 31.39 Favored Pre-proline 0 N--CA 1.479 0.994 0 CA-C-N 120.071 1.305 . . . . 0.0 111.142 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 144.09 62.51 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.315 2.676 . . . . 0.0 111.443 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 mt -59.68 -33.4 71.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.94 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.57 -43.75 89.53 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.26 0.936 . . . . 0.0 112.637 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.73 -38.94 77.03 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.95 0.5 . . . . 0.0 112.147 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.87 -47.27 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.476 0.71 . . . . 0.0 110.422 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.1 mt -62.52 -36.24 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.903 1.281 . . . . 0.0 111.144 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -61.86 -39.55 92.27 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.954 0.797 . . . . 0.0 112.385 170.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -70.01 -27.09 64.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.987 0.915 . . . . 0.0 113.278 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.7 t -69.39 -57.37 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.58 1.082 . . . . 0.0 110.82 169.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.5 p -63.96 -34.41 77.91 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.499 0.72 . . . . 0.0 112.557 -169.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.99 -27.61 68.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.31 1.044 . . . . 0.0 113.064 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.53 -22.98 70.12 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.305 0.955 . . . . 0.0 114.045 174.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -120.57 13.79 11.76 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.136 1.774 . . . . 0.0 113.106 176.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.4 m 55.77 29.22 13.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.249 1.82 . . . . 0.0 114.515 -178.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.91 128.2 33.17 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.659 1.183 . . . . 0.0 110.403 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.49 165.7 20.98 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.744 1.218 . . . . 0.0 113.35 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 53.87 63.1 2.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.121 1.769 . . . . 0.0 113.746 170.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -60.39 -19.98 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -177.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -57.32 -26.23 60.59 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.24 1.416 . . . . 0.0 113.193 171.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -81.37 -19.6 42.34 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.989 0.916 . . . . 0.0 112.782 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -92.09 157.88 16.51 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.583 1.182 . . . . 0.0 113.943 -169.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.32 154.38 41.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.014 2.526 . . . . 0.0 109.736 175.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.9 mt -89.69 151.19 21.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 167.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -142.05 147.0 36.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.636 1.174 . . . . 0.0 110.137 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 -65.18 143.21 58.0 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.36 -25.38 1.74 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.03 1.332 . . . . 0.0 113.308 174.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -73.21 -9.61 58.89 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.389 1.076 . . . . 0.0 112.97 168.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.5 t -144.47 -171.38 3.58 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.431 2.292 . . . . 0.0 109.961 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.7 m -54.79 153.03 6.48 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.397 1.079 . . . . 0.0 112.173 173.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -71.0 48.83 0.12 Allowed 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 126.963 2.105 . . . . 0.0 115.657 -169.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -70.98 132.94 45.94 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.318 -1.489 . . . . 0.0 111.508 171.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -74.63 141.12 44.67 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.308 0.643 . . . . 0.0 111.305 171.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 35.0 mm -80.3 132.81 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.37 1.068 . . . . 0.0 110.339 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 19.5 p -140.42 163.67 32.19 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.746 1.618 . . . . 0.0 111.023 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -61.27 -12.64 14.16 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.088 -1.008 . . . . 0.0 113.197 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -94.62 -15.24 24.18 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.156 1.782 . . . . 0.0 114.472 176.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -132.93 -7.73 3.09 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -176.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.95 -22.73 16.02 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -64.87 -18.26 65.01 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.569 1.548 . . . . 0.0 113.556 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -78.98 -14.54 59.15 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.097 0.959 . . . . 0.0 113.579 176.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.51 141.79 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 124.944 1.298 . . . . 0.0 110.101 174.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -127.4 160.87 30.1 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.212 1.405 . . . . 0.0 111.723 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -60.08 124.46 20.29 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.806 -0.559 . . . . 0.0 111.326 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.08 9.04 68.11 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.168 1.366 . . . . 0.0 115.174 -174.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 96.2 m -65.03 129.06 38.33 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.581 1.69 . . . . 0.0 111.105 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.0 mt -83.46 123.19 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 169.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -116.26 176.19 5.21 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.712 2.005 . . . . 0.0 110.161 174.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 33.5 ttp85 -143.94 135.94 26.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 126.367 1.867 . . . . 0.0 110.158 177.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 tp -77.64 140.53 39.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.844 0.858 . . . . 0.0 110.604 172.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.9 t -159.27 152.41 22.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.076 0.95 . . . . 0.0 111.425 -176.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 p -75.55 134.2 40.79 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.502 -1.374 . . . . 0.0 110.69 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 40.1 t -64.77 149.39 96.11 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.336 1.454 . . . . 0.0 113.625 -172.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -65.08 -15.29 49.69 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.994 2.463 . . . . 0.0 113.704 167.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -119.6 29.6 7.51 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.119 1.768 . . . . 0.0 114.082 -169.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -50.01 -44.24 51.08 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.49 1.116 . . . . 0.0 113.902 -175.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -93.53 -28.45 16.06 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.262 1.425 . . . . 0.0 113.6 175.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.36 -23.08 43.62 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -174.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 -60.77 135.48 57.79 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.531 1.132 . . . . 0.0 112.352 178.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -81.22 162.2 23.67 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.55 0.74 . . . . 0.0 112.054 172.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.84 137.63 40.59 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.209 0.604 . . . . 0.0 109.418 168.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -162.57 169.81 19.62 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.902 1.681 . . . . 0.0 110.664 174.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -148.25 96.3 2.6 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.929 0.892 . . . . 0.0 110.296 169.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 21.1 ttt85 -151.66 139.14 19.53 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.319 1.448 . . . . 0.0 111.632 -178.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.7 pt -107.02 -15.34 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.352 1.461 . . . . 0.0 114.495 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -160.53 159.62 30.91 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.073 1.349 . . . . 0.0 111.65 -172.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.3 p -68.22 -62.17 1.52 Allowed 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.658 -0.651 . . . . 0.0 110.614 169.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.7 t -162.03 144.58 11.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 126.518 1.927 . . . . 0.0 110.882 171.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.5 t -160.34 164.85 32.16 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.879 1.272 . . . . 0.0 112.0 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.2 ttt -144.71 129.96 18.67 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.753 1.621 . . . . 0.0 110.327 172.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -79.57 145.91 32.87 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -138.03 10.52 2.83 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.54 1.536 . . . . 0.0 113.314 175.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -70.47 129.07 38.27 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.18 1.392 . . . . 0.0 112.262 -178.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.1 tp -83.12 -31.91 26.98 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.461 1.104 . . . . 0.0 112.189 169.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -74.25 155.57 38.14 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.421 1.488 . . . . 0.0 112.829 175.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -153.56 169.2 23.8 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.598 1.559 . . . . 0.0 111.753 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.8 pp -143.31 170.23 16.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.474 1.509 . . . . 0.0 112.081 176.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -59.39 137.83 57.86 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.845 1.258 . . . . 0.0 112.549 -175.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.4 p-10 -141.86 -177.88 5.41 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.192 1.797 . . . . 0.0 112.081 -178.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 57.8 tp -144.34 142.96 30.73 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.758 1.623 . . . . 0.0 110.751 179.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -76.7 39.95 0.23 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.366 1.466 . . . . 0.0 113.795 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.3 p -84.91 -8.2 58.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.832 1.653 . . . . 0.0 114.798 -175.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 82.6 mt -66.11 151.47 46.84 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.581 1.153 . . . . 0.0 113.25 -176.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 23.9 t -65.95 137.94 57.49 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.459 0.704 . . . . 0.0 112.127 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? -78.92 152.13 31.31 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.119 1.368 . . . . 0.0 112.124 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.925 1.69 . . . . 0.0 112.875 175.414 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.619 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.6 mtt -70.33 155.0 94.12 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.041 0.936 . . . . 0.0 112.607 177.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.58 155.2 43.53 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.595 2.864 . . . . 0.0 113.837 174.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -65.38 156.11 65.07 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 123.404 2.736 . . . . 0.0 112.381 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.82 146.04 76.88 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.403 2.735 . . . . 0.0 112.571 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -79.22 1.23 25.44 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.409 1.262 . . . . 0.0 114.409 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -79.07 51.25 1.13 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.534 1.934 . . . . 0.0 112.75 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.8 mt -133.75 134.54 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.028 1.731 . . . . 0.0 109.028 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.03 131.09 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.896 1.278 . . . . 0.0 112.03 -174.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -75.5 140.85 43.05 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.068 0.947 . . . . 0.0 110.568 172.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -140.79 155.56 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.54 1.536 . . . . 0.0 111.241 -178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.53 143.94 38.51 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.24 1.016 . . . . 0.0 109.638 168.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.9 mt -131.27 123.86 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.617 0.767 . . . . 0.0 110.481 -170.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -81.77 143.23 31.95 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.336 1.454 . . . . 0.0 112.703 174.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -155.61 142.55 13.56 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.75 1.62 . . . . 0.0 110.508 169.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -63.75 142.92 85.04 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.723 2.282 . . . . 0.0 113.63 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.18 13.45 70.19 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.346 0.898 . . . . 0.0 115.346 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.27 156.58 46.41 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.262 1.425 . . . . 0.0 112.587 -177.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -70.19 153.37 95.31 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.652 0.781 . . . . 0.0 111.267 169.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.11 128.13 25.45 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.663 2.242 . . . . 0.0 112.502 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -83.33 123.36 29.56 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.814 0.846 . . . . 0.0 110.696 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 83.3 mt -85.79 135.59 33.67 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.529 0.732 . . . . 0.0 109.549 168.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -156.49 174.83 14.86 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.57 1.148 . . . . 0.0 111.486 174.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -120.2 118.34 30.24 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.245 1.018 . . . . 0.0 111.605 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.6 mt -83.69 111.28 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.241 1.417 . . . . 0.0 108.929 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -85.37 118.32 24.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.423 1.089 . . . . 0.0 109.629 169.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -68.56 -12.52 61.4 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -84.18 -23.65 30.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.515 1.126 . . . . 0.0 113.43 171.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -76.13 147.26 79.75 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 123.946 0.898 . . . . 0.0 111.929 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.84 144.14 63.83 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.974 2.45 . . . . 0.0 111.1 171.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.42 -32.08 72.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.994 -0.527 . . . . 0.0 112.173 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.6 m -58.4 -42.39 87.03 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.07 0.85 . . . . 0.0 112.555 174.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -41.61 71.93 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.897 -0.502 . . . . 0.0 111.958 175.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.09 -47.96 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.492 -0.755 . . . . 0.0 110.678 176.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.2 mt -59.82 -40.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.491 1.116 . . . . 0.0 110.671 177.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -58.99 -42.84 91.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.149 0.886 . . . . 0.0 112.514 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.59 -32.27 72.89 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.474 0.71 . . . . 0.0 112.469 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -68.57 -51.94 41.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 O-C-N 121.509 -0.744 . . . . 0.0 110.942 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 95.3 m -58.98 -44.1 91.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.785 0.834 . . . . 0.0 112.092 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -60.77 -29.38 69.39 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.218 1.007 . . . . 0.0 112.93 176.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.5 -23.52 66.87 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.241 0.924 . . . . 0.0 114.411 174.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -112.96 14.24 19.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.863 1.665 . . . . 0.0 113.261 171.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.3 m 55.33 25.96 8.13 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.914 1.686 . . . . 0.0 114.438 -175.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.82 119.49 17.12 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.813 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.47 165.03 25.88 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.388 1.075 . . . . 0.0 112.193 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.3 m120 55.23 53.87 9.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.326 1.45 . . . . 0.0 113.417 173.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -57.8 -17.57 16.67 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.244 1.018 . . . . 0.0 113.654 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -56.42 -20.46 19.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.835 1.654 . . . . 0.0 113.859 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -84.85 -15.92 43.06 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.639 1.576 . . . . 0.0 112.497 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -99.2 159.9 14.65 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.55 151.03 37.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.849 2.459 . . . . 0.0 109.81 171.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.3 mt -84.21 155.44 22.51 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 167.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -149.81 150.03 31.39 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.673 1.189 . . . . 0.0 110.044 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 -67.43 150.8 48.44 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.582 -0.698 . . . . 0.0 112.671 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.48 -6.19 2.92 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.722 1.209 . . . . 0.0 114.176 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -73.32 71.53 1.25 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.036 1.335 . . . . 0.0 111.755 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.2 m 62.63 -46.19 0.19 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 128.906 2.882 . . . . 0.0 115.558 -173.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.3 m -72.11 150.33 43.97 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.067 1.347 . . . . 0.0 111.604 169.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -130.08 37.11 3.94 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.539 1.535 . . . . 0.0 112.475 -178.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -65.69 134.41 53.16 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.169 -0.957 . . . . 0.0 110.911 171.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -67.86 144.29 55.36 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.965 -0.46 . . . . 0.0 110.354 169.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.9 mm -79.7 138.12 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.546 0.738 . . . . 0.0 110.715 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.4 p -146.3 173.37 12.31 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.492 2.317 . . . . 0.0 109.223 -175.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -58.47 -21.27 50.93 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 174.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -90.12 -45.65 8.99 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.775 1.23 . . . . 0.0 112.599 170.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -78.11 -21.16 50.82 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.994 0.918 . . . . 0.0 113.286 -171.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -57.81 -26.17 61.6 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.205 1.002 . . . . 0.0 113.676 173.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -74.0 -17.28 61.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.695 1.198 . . . . 0.0 113.071 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -79.4 -14.42 58.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.188 0.995 . . . . 0.0 112.831 173.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.3 mt -71.33 132.01 33.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.397 1.079 . . . . 0.0 109.641 174.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -122.88 165.24 16.99 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.903 1.681 . . . . 0.0 111.568 173.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -60.12 121.8 12.81 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 121.721 -0.612 . . . . 0.0 110.944 178.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.66 63.92 Favored Glycine 0 CA--C 1.541 1.663 0 C-N-CA 125.302 1.429 . . . . 0.0 115.648 -174.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.5 m -63.77 134.14 54.76 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.64 1.72 . . . . 0.0 111.191 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.6 mt -91.02 121.83 41.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 121.93 0.871 . . . . 0.0 109.3 169.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.2 mt -111.85 177.6 4.59 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.337 2.255 . . . . 0.0 110.434 176.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -139.24 145.89 39.78 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.144 1.778 . . . . 0.0 110.251 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.7 tp -85.11 140.16 31.17 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.718 0.807 . . . . 0.0 109.759 170.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -155.3 150.84 27.31 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.877 0.871 . . . . 0.0 111.061 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.3 p -76.13 134.33 40.0 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.796 -1.19 . . . . 0.0 110.435 169.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.4 t -64.04 137.56 97.14 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 123.676 0.79 . . . . 0.0 112.122 -175.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -69.78 -10.46 28.59 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 123.689 2.926 . . . . 0.0 113.885 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -111.32 3.82 18.58 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.733 1.613 . . . . 0.0 114.078 -177.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -73.67 -33.27 64.38 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -168.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -75.66 -39.6 57.39 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.128 0.971 . . . . 0.0 112.248 176.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -157.61 138.57 13.31 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.995 2.118 . . . . 0.0 109.018 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -66.14 125.08 24.38 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.638 0.775 . . . . 0.0 112.245 -170.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.35 -19.23 60.52 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.314 1.045 . . . . 0.0 112.953 177.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 29.9 tp -147.81 141.95 26.07 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.304 1.842 . . . . 0.0 110.839 -176.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -133.16 -0.02 3.37 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.782 1.233 . . . . 0.0 114.299 -175.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -152.26 151.29 30.75 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.383 1.873 . . . . 0.0 109.786 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 22.0 tpt85 -74.19 74.15 1.78 Allowed 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.944 0.878 . . . . 0.0 112.292 178.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 77.6 mt -65.93 154.01 8.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 124.963 1.305 . . . . 0.0 107.756 167.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -55.59 -31.31 62.11 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -173.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.4 t -139.77 151.19 45.59 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.796 1.638 . . . . 0.0 110.789 169.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.8 m -69.29 -17.0 63.69 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -174.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 79.4 p -155.46 158.92 39.33 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.725 1.61 . . . . 0.0 111.661 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 94.2 mtp -72.63 -24.89 61.12 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -139.95 149.91 43.87 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.547 1.939 . . . . 0.0 111.019 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.69 -9.95 59.59 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -178.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -67.52 139.8 56.98 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.876 1.27 . . . . 0.0 112.549 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.4 mt -78.55 159.8 27.96 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.515 1.126 . . . . 0.0 111.479 169.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -140.67 163.6 32.45 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.281 1.432 . . . . 0.0 112.312 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -76.53 56.89 1.16 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.24 1.416 . . . . 0.0 112.776 176.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -63.5 -13.22 38.71 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.432 1.493 . . . . 0.0 114.779 -171.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -57.34 -27.77 62.54 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.689 1.196 . . . . 0.0 113.602 170.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -76.29 -30.34 57.74 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.182 0.993 . . . . 0.0 112.918 174.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.1 tp -87.21 -28.56 22.31 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.587 1.555 . . . . 0.0 113.052 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.02 143.05 49.56 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.157 1.383 . . . . 0.0 113.728 -174.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.3 m -73.64 -13.97 61.09 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.296 1.438 . . . . 0.0 114.607 -174.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 35.8 mt 60.18 9.3 1.83 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 127.294 2.238 . . . . 0.0 115.27 -174.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 23.9 t -161.13 156.87 25.03 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 127.521 2.328 . . . . 0.0 109.585 176.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -83.84 134.93 34.68 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.775 0.83 . . . . 0.0 112.584 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 . . . . . 0 C--O 1.254 1.316 0 C-N-CA 124.719 1.208 . . . . 0.0 113.203 169.899 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.699 0 N-CA-C 112.059 -0.416 . . . . 0.0 112.059 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt -69.79 156.2 92.15 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.006 0.922 . . . . 0.0 112.717 177.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -60.24 158.36 31.06 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.401 2.734 . . . . 0.0 113.967 175.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -60.03 154.32 51.9 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.451 2.767 . . . . 0.0 113.892 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -59.38 145.18 98.67 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.569 2.846 . . . . 0.0 113.811 176.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.63 158.43 33.66 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.227 1.011 . . . . 0.0 112.879 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 46.7 p-10 -83.78 10.1 10.32 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.547 1.539 . . . . 0.0 113.868 172.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.3 mt -137.51 135.94 46.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 126.37 1.868 . . . . 0.0 108.745 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.4 m -133.36 133.28 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.929 1.292 . . . . 0.0 112.091 -176.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -78.85 140.32 38.19 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.931 0.892 . . . . 0.0 111.376 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.51 157.64 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 125.82 1.648 . . . . 0.0 111.638 -177.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.16 28.49 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.622 1.169 . . . . 0.0 110.201 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.3 mt -106.22 127.29 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 124.352 1.061 . . . . 0.0 110.442 -171.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 67.5 mt-10 -89.24 149.53 23.05 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.038 1.335 . . . . 0.0 112.994 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -151.63 142.86 15.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 126.093 1.757 . . . . 0.0 110.053 170.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -60.91 137.19 70.77 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.545 2.163 . . . . 0.0 113.54 -175.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.67 12.49 74.1 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.454 0.941 . . . . 0.0 115.454 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.9 153.4 51.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.201 1.4 . . . . 0.0 112.765 -178.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -69.64 151.41 96.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.653 0.781 . . . . 0.0 111.33 170.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.1 130.32 33.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 113.321 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.16 111.79 18.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.202 1.401 . . . . 0.0 110.234 175.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.8 127.87 33.11 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.404 0.682 . . . . 0.0 109.575 169.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -155.01 177.86 10.84 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.134 0.974 . . . . 0.0 111.602 173.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -113.34 135.07 54.26 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.933 . . . . 0.0 112.202 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.2 mt -95.57 110.01 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.721 1.608 . . . . 0.0 108.245 171.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -87.9 114.93 24.98 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.185 1.394 . . . . 0.0 110.074 175.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -70.9 -10.28 59.34 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -85.38 -21.93 28.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.372 1.069 . . . . 0.0 113.225 170.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -81.01 148.73 65.05 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 124.371 1.069 . . . . 0.0 112.781 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.05 146.39 76.87 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.94 2.427 . . . . 0.0 110.931 169.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -61.67 -29.85 70.35 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.556 177.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -58.7 -46.06 88.15 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.209 0.913 . . . . 0.0 112.232 172.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.14 -40.68 98.27 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.605 -0.684 . . . . 0.0 112.09 176.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 90.3 mt -66.42 -48.97 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.473 0.709 . . . . 0.0 110.568 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.78 -36.88 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.389 1.076 . . . . 0.0 110.94 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.69 -40.5 92.46 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.791 0.836 . . . . 0.0 112.304 171.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -70.74 -25.81 63.09 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.355 1.062 . . . . 0.0 113.589 173.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.83 -61.93 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.865 1.211 . . . . 0.0 110.902 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.9 p -63.51 -33.79 76.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.777 0.831 . . . . 0.0 112.76 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.02 -28.61 69.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.905 0.882 . . . . 0.0 113.017 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.94 -23.24 69.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.242 0.925 . . . . 0.0 114.205 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -115.79 12.99 16.04 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.864 1.666 . . . . 0.0 113.172 173.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m 55.78 27.04 10.23 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.0 1.72 . . . . 0.0 114.589 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.53 130.8 37.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.212 1.405 . . . . 0.0 110.738 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.65 163.84 21.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.598 1.159 . . . . 0.0 113.789 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 52.61 68.81 0.77 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.686 1.994 . . . . 0.0 113.65 169.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -63.58 -17.77 63.19 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 -171.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -54.65 -32.95 59.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.505 1.522 . . . . 0.0 112.989 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -73.09 -21.29 60.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.388 1.075 . . . . 0.0 112.692 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -94.53 158.3 15.6 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.587 1.184 . . . . 0.0 114.159 -169.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.28 150.04 34.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.679 2.391 . . . . 0.0 109.725 173.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.3 mt -81.86 158.58 23.97 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 166.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -148.93 148.12 29.44 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.573 1.149 . . . . 0.0 110.243 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -67.24 130.75 44.09 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.933 -0.48 . . . . 0.0 111.69 172.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.26 2.96 54.99 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.634 1.174 . . . . 0.0 113.849 178.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -70.99 -171.34 0.54 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.184 1.794 . . . . 0.0 112.102 175.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.5 m -58.9 -26.95 64.78 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.414 -1.428 . . . . 0.0 112.515 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.5 t -93.39 136.26 33.83 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.038 1.335 . . . . 0.0 110.342 168.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -126.14 39.84 3.86 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.373 1.469 . . . . 0.0 112.419 -172.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -61.19 136.76 58.17 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.524 -0.735 . . . . 0.0 111.519 169.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -68.68 145.87 53.49 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 167.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.1 mm -76.07 136.54 24.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.764 0.792 . . . . 0.0 110.108 174.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.4 p -142.86 171.42 14.08 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.251 2.22 . . . . 0.0 108.768 -175.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -59.95 -18.15 43.25 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.361 -0.837 . . . . 0.0 113.131 176.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -89.59 -54.07 4.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.907 1.683 . . . . 0.0 111.391 168.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -69.6 -23.59 63.55 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.12 0.968 . . . . 0.0 113.126 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -55.46 -27.95 51.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -73.21 -18.06 61.29 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.334 1.054 . . . . 0.0 112.972 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -85.44 -13.97 47.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.668 1.187 . . . . 0.0 112.648 176.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.8 mt -66.54 137.85 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.657 1.183 . . . . 0.0 109.648 172.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -137.43 165.76 25.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.406 1.882 . . . . 0.0 111.828 -179.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.39 124.54 18.44 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.852 -0.53 . . . . 0.0 112.015 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.61 10.24 73.6 Favored Glycine 0 CA--C 1.539 1.532 0 C-N-CA 124.843 1.211 . . . . 0.0 115.514 -175.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 91.9 m -63.57 128.7 37.01 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.761 1.781 . . . . 0.0 110.792 175.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -86.82 123.23 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.6 mt -119.07 174.09 6.52 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.18 1.792 . . . . 0.0 110.957 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -139.2 135.5 34.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.544 1.938 . . . . 0.0 109.996 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.3 tp -79.47 135.9 36.78 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.071 0.548 . . . . 0.0 109.664 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.6 t -155.65 154.48 31.66 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.158 0.983 . . . . 0.0 110.216 -175.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.7 p -71.96 134.48 45.99 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.411 -1.431 . . . . 0.0 110.386 169.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t -58.55 141.51 83.89 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.298 1.039 . . . . 0.0 110.614 174.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.53 -15.56 50.11 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.639 2.226 . . . . 0.0 112.861 176.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -96.92 -10.16 26.96 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.237 1.415 . . . . 0.0 114.254 170.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 53.99 27.92 8.02 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.031 1.732 . . . . 0.0 113.936 -168.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -146.89 172.81 13.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 128.626 2.77 . . . . 0.0 108.727 173.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.33 128.58 34.83 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.514 -0.741 . . . . 0.0 111.777 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -81.43 53.8 2.17 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.344 1.458 . . . . 0.0 113.152 -169.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -68.14 136.99 54.55 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.572 1.549 . . . . 0.0 113.557 -172.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mp -74.86 132.72 41.71 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.489 1.116 . . . . 0.0 110.506 170.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -80.4 -25.77 38.87 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -158.81 151.29 21.69 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.721 1.608 . . . . 0.0 111.206 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 62.4 ttt-85 -74.9 116.24 15.41 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.277 1.031 . . . . 0.0 110.284 174.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.9 mt -71.37 -43.85 72.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.66 0.784 . . . . 0.0 111.439 -174.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.73 127.42 32.77 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.018 0.927 . . . . 0.0 110.756 175.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 78.7 p -75.79 -28.96 58.57 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -174.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 34.5 t -155.79 152.06 28.0 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.514 1.526 . . . . 0.0 111.17 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.4 t -74.55 65.84 1.33 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.562 1.545 . . . . 0.0 112.903 -176.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 69.6 mtm -69.66 162.02 28.52 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.183 1.793 . . . . 0.0 112.599 176.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -60.4 127.83 33.71 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.27 1.028 . . . . 0.0 111.692 177.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.49 -13.78 62.25 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -122.17 143.91 49.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.254 1.422 . . . . 0.0 112.776 -177.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.6 tp -84.42 131.73 34.64 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.412 1.485 . . . . 0.0 110.156 169.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -76.7 -34.38 58.17 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -177.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -164.32 155.65 15.73 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.94 1.696 . . . . 0.0 111.215 -179.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.92 133.44 50.9 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.678 -0.638 . . . . 0.0 110.42 170.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -74.3 134.88 42.58 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.884 0.874 . . . . 0.0 111.881 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -79.45 144.39 34.08 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.932 0.893 . . . . 0.0 111.877 171.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 96.4 mt -140.08 134.18 30.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.618 1.567 . . . . 0.0 110.609 177.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -158.9 156.23 29.17 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.588 1.555 . . . . 0.0 111.537 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.4 t -72.92 148.66 44.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.323 0.649 . . . . 0.0 112.092 171.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.3 mt -79.51 -9.48 59.62 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.573 1.149 . . . . 0.0 113.53 174.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 60.4 m -136.28 153.29 51.22 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.471 1.508 . . . . 0.0 112.759 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -68.52 -33.97 75.06 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.548 1.139 . . . . 0.0 112.982 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.4 t0 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.542 1.937 . . . . 0.0 111.822 -179.01 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.5 mtt -140.42 149.8 58.74 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.626 1.57 . . . . 0.0 111.574 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.18 159.22 54.7 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 123.415 2.744 . . . . 0.0 113.01 177.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.46 162.09 38.16 Favored 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 123.519 2.813 . . . . 0.0 112.309 172.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -76.24 53.23 3.79 Favored 'Trans proline' 0 CA--C 1.551 1.352 0 C-N-CA 124.957 3.771 . . . . 0.0 112.904 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 60.49 166.74 0.08 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 128.014 2.526 . . . . 0.0 115.05 -171.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -80.59 49.58 1.19 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.306 1.442 . . . . 0.0 112.143 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt -125.65 135.43 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.141 1.377 . . . . 0.0 110.557 -170.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.0 m -129.55 126.41 63.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.585 1.554 . . . . 0.0 111.597 -178.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -74.13 140.23 45.08 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.981 0.912 . . . . 0.0 110.84 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 m -137.91 154.45 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.13 1.372 . . . . 0.0 111.83 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.08 38.8 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.946 1.298 . . . . 0.0 109.615 171.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.4 mt -110.18 123.95 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.725 0.81 . . . . 0.0 110.38 -170.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -88.57 153.32 21.22 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.886 1.274 . . . . 0.0 113.238 176.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -153.76 142.48 14.47 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 126.134 1.773 . . . . 0.0 109.658 169.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -60.12 133.94 53.09 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.51 2.14 . . . . 0.0 113.295 -175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.93 11.04 78.37 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 115.409 0.924 . . . . 0.0 115.409 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.49 151.56 51.46 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.975 1.387 . . . . 0.0 112.805 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -70.34 150.27 95.83 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.703 0.801 . . . . 0.0 111.371 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -61.09 130.18 31.53 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.421 2.08 . . . . 0.0 113.383 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -83.55 111.15 18.82 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.121 1.368 . . . . 0.0 110.124 175.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.43 132.47 39.68 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.674 0.79 . . . . 0.0 110.227 169.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -157.24 178.08 10.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.411 1.085 . . . . 0.0 111.688 177.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -122.21 131.25 53.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.492 1.117 . . . . 0.0 112.174 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 mt -100.19 109.79 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.636 1.575 . . . . 0.0 108.864 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -81.14 117.85 22.04 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 168.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -65.05 -13.89 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -86.22 -22.21 27.03 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.758 1.223 . . . . 0.0 114.087 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -86.13 149.56 50.34 Favored Pre-proline 0 N--CA 1.483 1.181 0 CA-C-N 119.778 1.172 . . . . 0.0 111.691 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.47 144.01 39.74 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.067 2.512 . . . . 0.0 112.337 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.4 mt -61.77 -31.73 71.95 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.445 0.698 . . . . 0.0 112.438 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.4 m -59.38 -42.4 91.61 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.168 0.894 . . . . 0.0 112.301 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.5 81.83 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.145 0.578 . . . . 0.0 111.902 175.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.81 -50.76 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.492 0.717 . . . . 0.0 110.581 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.5 mt -61.51 -38.54 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.073 -1.017 . . . . 0.0 110.865 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.3 -38.95 88.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.721 0.809 . . . . 0.0 112.552 171.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -72.25 -27.81 62.74 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.396 1.079 . . . . 0.0 113.488 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.41 -61.11 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.259 -0.9 . . . . 0.0 111.098 172.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 30.2 p -61.55 -33.45 73.86 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.582 0.753 . . . . 0.0 112.849 -171.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -60.27 -30.85 69.72 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.325 1.05 . . . . 0.0 112.893 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -23.13 67.93 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.378 0.989 . . . . 0.0 114.064 175.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -114.9 12.36 16.85 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.955 1.702 . . . . 0.0 113.307 173.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.3 p 55.93 22.67 5.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 127.284 2.233 . . . . 0.0 115.4 -176.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.62 125.99 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.083 1.353 . . . . 0.0 110.677 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.0 166.2 22.6 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.636 1.174 . . . . 0.0 113.4 -177.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 m120 54.06 63.13 2.29 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.984 1.714 . . . . 0.0 113.397 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -59.85 -25.44 65.03 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.208 -0.933 . . . . 0.0 113.482 -174.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -64.73 -15.84 62.08 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.852 1.261 . . . . 0.0 113.89 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -77.81 -20.87 52.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.161 -0.962 . . . . 0.0 112.407 168.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -94.38 160.81 14.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.903 1.281 . . . . 0.0 114.145 -169.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.43 157.38 43.76 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.829 2.451 . . . . 0.0 109.917 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 40.3 mt -87.41 151.69 22.86 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 167.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -139.22 144.4 38.46 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.813 1.245 . . . . 0.0 109.959 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -65.0 141.42 58.78 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.061 0.544 . . . . 0.0 112.377 176.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -129.26 -28.99 2.28 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.893 1.277 . . . . 0.0 112.776 174.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -70.56 -47.76 58.7 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.466 -0.771 . . . . 0.0 110.821 168.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 t -84.83 -177.07 6.49 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.937 1.295 . . . . 0.0 111.408 169.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.4 t -60.31 162.11 6.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.868 0.867 . . . . 0.0 111.718 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.99 38.61 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 127.341 2.257 . . . . 0.0 116.969 -169.015 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -68.35 135.48 51.88 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.136 -1.603 . . . . 0.0 111.697 173.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -70.8 144.74 50.72 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.678 -0.639 . . . . 0.0 110.645 169.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -77.92 134.06 29.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.507 0.723 . . . . 0.0 109.673 173.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -139.31 169.55 17.56 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.97 1.708 . . . . 0.0 109.776 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -58.41 -21.29 50.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.099 0.96 . . . . 0.0 113.385 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -93.59 -47.48 6.8 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.295 1.438 . . . . 0.0 112.667 169.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -76.64 -17.25 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -54.29 -25.45 23.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.967 1.307 . . . . 0.0 114.231 171.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -67.54 -15.87 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.072 0.949 . . . . 0.0 113.512 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -79.17 -11.63 59.97 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.077 0.951 . . . . 0.0 113.426 171.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.0 mt -71.53 134.47 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 O-C-N 121.272 -0.893 . . . . 0.0 109.771 173.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -121.5 166.36 14.27 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.843 2.057 . . . . 0.0 111.629 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -57.57 124.03 17.64 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 121.855 -0.528 . . . . 0.0 110.738 173.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.51 11.59 68.54 Favored Glycine 0 CA--C 1.539 1.549 0 C-N-CA 125.11 1.338 . . . . 0.0 115.465 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.4 m -65.12 131.62 47.02 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 119.455 1.628 . . . . 0.0 111.599 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.3 mt -85.31 124.4 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 169.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.6 mt -119.46 174.65 6.25 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.845 2.058 . . . . 0.0 110.263 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -141.92 137.46 31.32 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.938 1.695 . . . . 0.0 110.181 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -77.09 139.84 40.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.956 0.902 . . . . 0.0 110.595 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.2 t -157.35 151.38 24.6 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.976 0.911 . . . . 0.0 111.242 -176.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.0 p -69.86 126.71 30.51 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.565 -1.335 . . . . 0.0 110.321 169.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 45.0 t -65.0 140.84 98.23 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 125.121 1.369 . . . . 0.0 111.875 -177.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.17 -29.57 56.91 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.002 2.468 . . . . 0.0 113.313 172.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.96 -19.9 47.45 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -72.09 -10.13 59.36 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.391 0.996 . . . . 0.0 113.574 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -137.49 -61.15 0.65 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.821 1.248 . . . . 0.0 112.97 178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -162.65 137.68 6.82 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.407 1.483 . . . . 0.0 111.714 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -146.13 72.77 1.31 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.679 1.192 . . . . 0.0 110.799 178.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -71.43 150.88 44.52 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.427 1.091 . . . . 0.0 112.894 -178.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.2 tp -67.82 150.5 48.53 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.519 1.128 . . . . 0.0 111.509 171.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -138.98 157.94 45.1 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.117 1.367 . . . . 0.0 112.304 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -80.98 65.53 6.16 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.275 1.43 . . . . 0.0 113.032 -171.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -0.96 1.87 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.6 1.56 . . . . 0.0 114.821 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 94.3 mt -54.58 -36.29 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.999 1.32 . . . . 0.0 111.269 175.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -88.06 133.77 33.9 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.801 1.24 . . . . 0.0 112.795 173.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.0 p -163.19 152.0 14.42 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.759 1.624 . . . . 0.0 111.148 169.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.9 t -71.46 149.82 45.51 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.807 0.843 . . . . 0.0 112.983 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 80.0 p -77.22 -7.66 56.28 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.324 1.45 . . . . 0.0 113.675 171.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 76.9 mtm -134.35 165.08 25.97 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.953 1.701 . . . . 0.0 112.307 -176.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -149.67 164.73 34.4 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.151 1.38 . . . . 0.0 111.512 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.36 159.37 34.13 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.656 1.182 . . . . 0.0 112.711 174.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 32.6 tttp 59.86 22.24 11.2 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.386 1.875 . . . . 0.0 115.283 173.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.3 mt -77.52 -24.11 50.05 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.221 1.009 . . . . 0.0 113.129 174.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -74.78 153.21 38.88 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.506 1.523 . . . . 0.0 113.085 176.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -153.23 155.4 36.53 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.935 1.294 . . . . 0.0 112.272 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.1 pp -72.6 165.19 25.19 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.539 1.135 . . . . 0.0 112.539 172.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -144.53 152.75 41.02 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.23 1.412 . . . . 0.0 112.665 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 39.2 p-10 -88.65 174.39 8.07 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.649 1.58 . . . . 0.0 112.315 171.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 94.9 mt -126.35 151.38 47.67 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.882 1.673 . . . . 0.0 111.132 175.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -152.67 171.35 18.32 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.216 1.406 . . . . 0.0 112.315 -175.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 40.3 t -145.65 148.71 33.37 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.419 1.488 . . . . 0.0 111.728 176.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 84.2 mt -75.91 -11.42 59.96 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.68 1.192 . . . . 0.0 113.213 173.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.7 t 54.47 47.84 21.89 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.354 1.462 . . . . 0.0 112.197 -173.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -62.05 134.82 57.11 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.698 1.599 . . . . 0.0 112.15 -173.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 . . . . . 0 C--O 1.253 1.249 0 C-N-CA 126.632 1.973 . . . . 0.0 113.242 174.897 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.0 mmm 63.26 159.28 0.12 Allowed Pre-proline 0 N--CA 1.482 1.149 0 C-N-CA 127.342 2.257 . . . . 0.0 114.838 -173.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -61.59 141.06 90.07 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 122.951 2.434 . . . . 0.0 113.335 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.51 150.33 87.91 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.215 2.61 . . . . 0.0 113.369 175.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.54 3.25 5.52 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.938 3.092 . . . . 0.0 115.043 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.29 4.03 21.96 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.273 1.829 . . . . 0.0 113.873 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.0 p-10 -75.63 7.16 3.97 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.698 1.599 . . . . 0.0 115.167 -178.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.6 mt -137.29 134.95 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 125.97 1.708 . . . . 0.0 108.89 170.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -135.48 132.82 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.056 1.342 . . . . 0.0 112.136 -177.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -71.34 141.14 50.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.98 0.912 . . . . 0.0 111.396 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.3 m -141.81 155.14 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.942 1.297 . . . . 0.0 111.927 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.16 39.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.898 1.279 . . . . 0.0 109.792 171.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -109.18 125.23 66.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.922 0.889 . . . . 0.0 110.48 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -91.89 151.05 20.73 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.879 1.272 . . . . 0.0 113.381 177.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -151.35 143.38 16.08 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.069 1.748 . . . . 0.0 109.937 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -59.67 135.16 62.25 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.544 2.162 . . . . 0.0 113.505 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.58 11.32 76.92 Favored Glycine 0 CA--C 1.539 1.571 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -132.81 152.37 51.82 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.873 1.336 . . . . 0.0 112.866 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -70.44 152.18 95.51 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 123.689 0.796 . . . . 0.0 111.515 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.34 129.72 29.37 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.5 2.133 . . . . 0.0 113.265 -178.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -82.56 109.31 16.65 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.205 1.402 . . . . 0.0 110.05 174.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.8 131.9 40.06 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.723 0.809 . . . . 0.0 110.205 170.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -156.48 178.19 10.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.198 0.999 . . . . 0.0 112.067 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -118.58 122.45 42.65 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.701 1.2 . . . . 0.0 111.474 174.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.3 mt -84.78 108.46 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 124.425 1.09 . . . . 0.0 108.257 169.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -81.77 114.86 20.7 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.094 0.957 . . . . 0.0 108.825 169.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.01 -12.07 60.1 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -175.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -88.44 -23.06 23.39 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.761 1.224 . . . . 0.0 113.422 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -78.94 143.07 61.1 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.182 0.993 . . . . 0.0 111.295 174.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.52 144.41 66.75 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.089 2.526 . . . . 0.0 111.411 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -61.69 -30.06 70.5 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 118.78 -0.629 . . . . 0.0 112.615 178.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.3 p -59.98 -44.68 94.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.644 1.111 . . . . 0.0 112.402 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.72 -40.02 88.25 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.263 0.625 . . . . 0.0 112.055 174.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.7 -46.89 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.585 0.754 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.05 -37.02 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.581 1.153 . . . . 0.0 111.077 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -61.49 -38.62 87.97 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.743 0.701 . . . . 0.0 112.32 171.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -72.03 -25.13 61.69 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.329 1.052 . . . . 0.0 113.337 174.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 46.4 t -72.07 -57.6 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.277 0.944 . . . . 0.0 110.976 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.7 p -62.18 -33.76 75.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.865 0.866 . . . . 0.0 112.562 -169.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.17 -28.94 69.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.557 1.143 . . . . 0.0 113.029 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.11 -23.0 69.41 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.303 0.954 . . . . 0.0 114.088 175.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -117.73 10.28 13.28 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.052 1.741 . . . . 0.0 113.193 174.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.0 t 54.69 33.6 19.77 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.274 1.83 . . . . 0.0 113.865 -176.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -80.69 125.21 29.75 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.708 1.203 . . . . 0.0 110.489 179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.26 165.82 22.81 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.77 1.228 . . . . 0.0 113.245 -178.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 54.03 59.83 4.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.922 1.689 . . . . 0.0 113.569 172.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -60.24 -19.97 56.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -176.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -56.27 -29.27 60.9 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.237 1.415 . . . . 0.0 112.913 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -78.9 -19.75 51.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.015 0.926 . . . . 0.0 112.726 178.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -91.16 158.32 16.69 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -169.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.73 150.67 35.82 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.354 2.262 . . . . 0.0 110.086 172.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -82.54 153.45 25.53 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 167.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -145.4 150.36 36.4 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.826 1.25 . . . . 0.0 109.698 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -63.42 138.86 58.67 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.487 -0.758 . . . . 0.0 111.146 173.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.96 -8.7 57.86 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 -174.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -67.31 176.55 2.21 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.918 1.287 . . . . 0.0 112.983 175.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 17.5 m -63.72 -10.77 21.27 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 99.4 p -70.67 165.55 22.67 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.355 1.462 . . . . 0.0 112.852 172.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -102.09 12.44 36.8 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.586 1.554 . . . . 0.0 113.712 178.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 12.4 m-30 -63.57 100.08 0.25 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.382 1.073 . . . . 0.0 113.183 -169.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -70.95 143.37 50.91 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.762 0.825 . . . . 0.0 110.964 170.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.4 mm -82.19 129.6 37.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 124.375 1.07 . . . . 0.0 109.283 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.7 p -142.53 167.19 22.68 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.619 1.568 . . . . 0.0 109.965 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -63.1 -10.01 12.91 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 120.979 -1.076 . . . . 0.0 113.451 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -105.68 -4.88 20.49 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.517 1.927 . . . . 0.0 114.406 173.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -130.22 -14.48 3.83 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -174.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.55 -18.47 59.38 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 178.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.47 -22.58 66.97 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.869 1.268 . . . . 0.0 112.959 174.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -75.15 -14.17 60.53 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.987 0.915 . . . . 0.0 113.184 177.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -73.77 132.64 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.472 1.109 . . . . 0.0 110.172 177.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -118.13 167.31 11.6 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.144 1.778 . . . . 0.0 111.886 170.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -59.41 127.27 31.23 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.633 -0.667 . . . . 0.0 110.979 172.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.77 10.35 69.96 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.041 1.305 . . . . 0.0 115.305 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.5 m -65.98 131.39 46.13 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.563 1.682 . . . . 0.0 111.084 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mt -89.74 125.02 42.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 172.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 89.5 mt -120.37 173.45 7.13 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.679 1.992 . . . . 0.0 110.578 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -139.83 146.88 39.93 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.793 1.637 . . . . 0.0 110.594 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.7 tp -85.22 138.98 32.0 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.219 1.008 . . . . 0.0 110.173 173.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.7 t -157.65 156.37 31.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.157 0.983 . . . . 0.0 110.871 -176.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.4 p -71.02 139.26 50.43 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.415 -1.428 . . . . 0.0 110.568 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.9 p -63.05 158.49 54.36 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 126.011 1.724 . . . . 0.0 113.635 -171.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -67.49 -26.01 40.89 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.078 1.852 . . . . 0.0 112.11 169.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.22 -31.26 71.5 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.72 1.208 . . . . 0.0 113.74 -177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.42 -10.82 59.69 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 177.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -90.33 143.31 26.88 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.413 1.085 . . . . 0.0 112.619 -176.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . 57.28 179.44 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.957 2.103 . . . . 0.0 115.762 175.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -70.3 142.28 52.26 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.838 1.255 . . . . 0.0 111.604 175.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -83.01 -14.05 54.72 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 52.6 tp -69.44 139.21 54.0 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.973 1.309 . . . . 0.0 112.359 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 35.0 p80 -151.81 167.55 27.91 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.5 1.52 . . . . 0.0 111.799 176.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -151.03 164.87 35.43 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.512 1.525 . . . . 0.0 111.717 176.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -140.9 145.54 36.25 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.726 1.611 . . . . 0.0 111.811 -177.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 39.8 pt -69.07 158.78 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.922 1.289 . . . . 0.0 112.901 178.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -143.38 27.48 1.55 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.462 1.505 . . . . 0.0 112.584 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 79.4 p -69.71 -17.36 63.46 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -171.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 33.8 t -153.12 143.05 22.17 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.76 1.224 . . . . 0.0 112.283 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.2 t -160.48 155.19 23.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.293 1.837 . . . . 0.0 110.661 175.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 91.0 mtp -75.62 133.77 40.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.841 0.856 . . . . 0.0 111.839 177.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -72.96 -28.5 62.46 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -153.99 151.99 30.03 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.94 1.696 . . . . 0.0 111.051 176.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -138.9 107.32 5.82 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.596 1.558 . . . . 0.0 110.681 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.9 mt -84.02 -32.71 24.76 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.354 1.062 . . . . 0.0 113.464 -176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 51.74 34.88 13.87 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.514 1.926 . . . . 0.0 114.615 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.36 139.09 58.53 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.829 1.252 . . . . 0.0 113.367 -175.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.7 mt -82.71 162.9 21.63 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.058 1.343 . . . . 0.0 112.128 174.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -146.31 150.08 35.07 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.3 1.44 . . . . 0.0 112.547 175.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -93.68 151.34 19.72 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.846 1.259 . . . . 0.0 111.763 172.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 96.5 mt -138.44 143.59 39.75 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.713 1.605 . . . . 0.0 110.889 176.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.85 153.17 37.0 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.183 0.993 . . . . 0.0 112.962 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.0 p -155.71 149.99 25.75 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.202 1.401 . . . . 0.0 111.824 175.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -156.65 161.6 39.88 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.721 1.608 . . . . 0.0 111.98 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 22.6 t -154.58 155.13 34.19 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.146 1.378 . . . . 0.0 111.539 174.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -75.65 164.27 26.47 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.174 1.39 . . . . 0.0 112.396 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 . . . . . 0 C--O 1.254 1.32 0 C-N-CA 127.342 2.257 . . . . 0.0 114.002 175.379 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.669 0 N-CA-C 112.076 -0.41 . . . . 0.0 112.076 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.6 tpt -149.81 126.27 5.24 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 125.283 1.433 . . . . 0.0 110.52 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -71.74 160.09 49.01 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 123.036 2.491 . . . . 0.0 112.868 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -59.73 153.56 55.3 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.489 2.792 . . . . 0.0 113.51 173.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -65.79 148.71 86.82 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.318 2.679 . . . . 0.0 112.229 175.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.89 153.96 38.41 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.077 0.951 . . . . 0.0 113.251 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -85.63 15.84 4.35 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.439 1.496 . . . . 0.0 114.068 178.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.6 mt -66.42 139.88 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.252 1.421 . . . . 0.0 111.416 -175.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.5 m -133.67 135.36 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.033 1.733 . . . . 0.0 111.52 178.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.3 tttp -77.91 145.88 35.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.168 0.987 . . . . 0.0 110.873 172.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.9 m -141.73 155.5 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.777 1.631 . . . . 0.0 111.563 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.62 113.28 20.99 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.922 1.289 . . . . 0.0 109.992 174.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.7 mt -102.07 126.21 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.763 0.825 . . . . 0.0 110.839 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -82.9 143.1 30.96 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.722 1.609 . . . . 0.0 112.754 175.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -156.03 142.99 13.58 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.817 1.647 . . . . 0.0 110.429 170.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -63.24 143.9 90.55 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.699 2.266 . . . . 0.0 113.775 -174.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.84 71.42 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 115.476 0.95 . . . . 0.0 115.476 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -142.11 157.32 45.03 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.201 1.4 . . . . 0.0 112.641 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -70.21 154.1 94.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 123.762 0.825 . . . . 0.0 111.452 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.86 129.8 32.12 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.647 2.232 . . . . 0.0 112.746 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -81.15 109.63 15.88 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.095 0.958 . . . . 0.0 110.303 176.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.4 mt -76.91 126.16 30.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.48 0.712 . . . . 0.0 109.664 169.447 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.4 ptm -154.15 178.47 9.95 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.115 0.966 . . . . 0.0 111.766 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -115.96 137.72 51.85 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.401 1.081 . . . . 0.0 111.983 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.8 mt -105.33 114.03 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 C-N-CA 126.014 1.726 . . . . 0.0 108.717 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -87.53 119.93 28.33 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.887 0.875 . . . . 0.0 109.071 168.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -65.93 -15.07 62.64 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -83.95 -21.2 31.88 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.621 1.168 . . . . 0.0 113.977 172.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -80.2 146.97 63.81 Favored Pre-proline 0 N--CA 1.481 1.08 0 CA-C-N 119.386 0.994 . . . . 0.0 111.902 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.67 142.42 52.98 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.724 2.283 . . . . 0.0 111.06 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.5 mt -62.82 -29.61 70.86 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.298 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.6 p -60.83 -44.12 97.37 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.419 1.009 . . . . 0.0 112.576 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.87 87.63 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.574 0.625 . . . . 0.0 112.096 175.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.56 -48.38 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.345 0.658 . . . . 0.0 110.282 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -36.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.458 1.103 . . . . 0.0 111.213 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.68 -44.7 93.51 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.146 0.885 . . . . 0.0 112.066 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -66.51 -29.31 69.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.338 1.055 . . . . 0.0 113.074 174.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.92 -55.43 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.343 0.974 . . . . 0.0 110.514 169.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.07 -41.3 99.41 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.835 0.854 . . . . 0.0 112.182 -173.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.81 -27.29 68.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.634 0.774 . . . . 0.0 112.91 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.63 -23.58 67.15 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.425 1.012 . . . . 0.0 114.3 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -117.51 16.19 14.64 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.92 1.688 . . . . 0.0 113.144 172.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.1 m 55.59 26.42 9.14 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.92 1.688 . . . . 0.0 114.55 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.3 mt -72.46 125.41 27.35 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.113 1.365 . . . . 0.0 111.405 -178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.16 152.93 41.95 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.353 1.061 . . . . 0.0 112.352 176.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 49.27 68.11 0.78 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.458 1.903 . . . . 0.0 113.232 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -57.45 -17.25 12.29 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.971 1.308 . . . . 0.0 113.425 177.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -54.86 -27.93 46.21 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.705 1.602 . . . . 0.0 112.914 173.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -76.61 -18.37 58.65 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.938 0.895 . . . . 0.0 112.87 178.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -95.82 159.96 14.72 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -168.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.42 145.82 32.13 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.584 2.354 . . . . 0.0 109.563 172.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.46 154.96 28.53 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.456 0.646 . . . . 0.0 109.27 167.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -144.95 149.16 34.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 124.973 1.309 . . . . 0.0 110.019 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 -66.05 150.93 47.93 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.678 -0.639 . . . . 0.0 111.871 170.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.4 -21.02 1.05 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.357 1.063 . . . . 0.0 113.671 169.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -70.9 -72.55 0.2 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.466 1.106 . . . . 0.0 112.955 177.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 64.8 m -94.13 -19.11 21.1 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -172.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 t -161.36 -173.36 3.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.444 1.497 . . . . 0.0 111.35 -174.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -121.74 22.28 10.54 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.04 2.136 . . . . 0.0 112.6 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -61.38 136.94 58.21 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.7 -1.25 . . . . 0.0 111.925 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -70.22 141.54 52.5 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.736 -0.602 . . . . 0.0 109.712 168.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.6 mm -74.59 135.45 27.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.169 0.588 . . . . 0.0 110.291 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 p -142.12 173.02 11.9 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.775 2.03 . . . . 0.0 109.436 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -57.82 -22.69 48.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -90.32 -48.94 6.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.824 1.25 . . . . 0.0 112.362 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -74.79 -20.13 59.92 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.162 0.985 . . . . 0.0 113.306 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -54.99 -26.53 37.5 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.423 1.089 . . . . 0.0 113.843 171.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -72.6 -15.92 61.73 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.317 1.047 . . . . 0.0 113.376 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.22 -13.04 60.02 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.162 0.985 . . . . 0.0 112.894 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.0 mt -70.52 129.99 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.98 0.912 . . . . 0.0 109.65 174.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -111.47 165.29 12.11 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.247 1.819 . . . . 0.0 111.867 170.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -61.29 125.5 23.97 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.604 -0.685 . . . . 0.0 110.929 174.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.67 13.71 69.44 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.039 1.304 . . . . 0.0 115.392 -174.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.0 m -64.55 131.0 45.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 119.763 1.782 . . . . 0.0 111.69 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.6 mt -80.68 121.32 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 168.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -113.91 177.96 4.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.333 1.853 . . . . 0.0 110.455 176.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -143.18 136.27 27.98 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 126.813 2.045 . . . . 0.0 110.285 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.4 tp -82.11 137.65 34.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.274 0.63 . . . . 0.0 109.734 169.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.1 t -155.87 154.63 31.57 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.121 0.968 . . . . 0.0 110.241 -177.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.5 p -70.03 141.0 52.94 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.547 -1.346 . . . . 0.0 110.571 170.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.2 t -58.84 147.06 73.82 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 125.767 1.627 . . . . 0.0 113.164 -172.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.14 -21.8 55.14 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 122.808 2.339 . . . . 0.0 112.804 171.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -87.96 -59.33 2.27 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.834 1.254 . . . . 0.0 111.984 171.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 50.32 33.06 6.93 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.968 2.107 . . . . 0.0 115.242 -176.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -150.03 154.04 37.51 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.967 1.307 . . . . 0.0 111.712 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -150.12 81.95 1.37 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.78 1.632 . . . . 0.0 110.675 -178.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -62.54 -23.71 67.13 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 13.3 pm0 -77.3 -1.49 30.07 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.297 1.839 . . . . 0.0 114.779 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 60.3 tp -58.8 123.66 17.19 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.717 1.207 . . . . 0.0 112.822 -176.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -77.82 162.25 27.04 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.184 1.394 . . . . 0.0 113.287 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.8 mp0 -64.85 157.73 27.03 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.189 1.396 . . . . 0.0 112.848 173.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -64.27 139.84 58.81 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.785 1.234 . . . . 0.0 112.051 178.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.2 pt -136.19 159.18 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 126.5 1.92 . . . . 0.0 111.448 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -71.97 147.22 47.15 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.997 0.919 . . . . 0.0 112.269 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 64.3 m -100.51 149.73 23.4 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.953 1.301 . . . . 0.0 112.626 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 37.2 m -68.26 154.1 42.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.717 1.207 . . . . 0.0 112.8 174.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 93.3 p -138.3 -4.17 1.69 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -177.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 62.6 ttp -62.42 -27.21 68.94 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.026 -1.046 . . . . 0.0 113.464 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -68.16 -8.63 40.21 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.868 1.267 . . . . 0.0 114.348 178.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.32 -20.03 65.98 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 69.1 tttt 53.19 31.96 12.45 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.352 1.861 . . . . 0.0 113.798 177.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.9 pp -71.02 -8.63 54.71 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -169.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -82.15 12.9 3.8 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.679 1.592 . . . . 0.0 115.237 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.83 152.36 12.72 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.087 1.755 . . . . 0.0 113.724 171.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.6 mt -135.79 155.11 50.86 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.015 1.726 . . . . 0.0 111.596 179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.15 -9.76 1.74 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.954 1.835 . . . . 0.0 115.954 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -82.7 47.41 1.19 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.257 1.423 . . . . 0.0 112.874 -176.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.3 mp -75.29 147.37 40.25 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.019 1.328 . . . . 0.0 111.53 -178.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -152.11 160.21 43.47 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.269 1.428 . . . . 0.0 112.161 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.7 t -70.63 -32.8 70.24 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.026 0.93 . . . . 0.0 112.696 175.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.04 136.12 55.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.003 1.321 . . . . 0.0 111.82 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 27.1 m -63.21 140.05 58.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.591 1.157 . . . . 0.0 113.063 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -72.72 146.74 46.23 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.89 1.276 . . . . 0.0 111.588 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.16 1.384 . . . . 0.0 113.711 176.729 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 112.117 -0.393 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.9 ttp -65.65 136.41 95.98 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.334 1.054 . . . . 0.0 111.74 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.18 152.91 78.92 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.036 2.491 . . . . 0.0 112.705 177.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -70.33 156.62 61.45 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.434 2.756 . . . . 0.0 112.442 178.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -77.65 42.9 1.24 Allowed 'Trans proline' 0 CA--C 1.551 1.351 0 C-N-CA 124.78 3.653 . . . . 0.0 112.517 174.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -150.43 162.8 39.87 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.001 1.72 . . . . 0.0 112.009 -172.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 58.0 26.55 13.61 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.842 1.657 . . . . 0.0 114.332 -177.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 19.6 mt -106.25 144.24 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 125.35 1.46 . . . . 0.0 111.307 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.41 129.83 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 126.27 1.828 . . . . 0.0 110.867 175.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -73.61 143.32 46.41 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.956 0.902 . . . . 0.0 110.397 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.36 151.36 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.196 1.398 . . . . 0.0 111.171 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.09 129.01 56.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.526 1.13 . . . . 0.0 109.95 171.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -118.44 122.58 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.865 0.866 . . . . 0.0 110.821 -169.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -81.73 141.54 33.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.276 1.43 . . . . 0.0 112.86 175.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TRP . . . . . 0.43 ' CD2' ' HD2' ' A' ' 15' ' ' PRO . 68.6 t-105 -158.84 139.53 9.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.677 1.991 . . . . 0.0 109.626 169.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.43 ' HD2' ' CD2' ' A' ' 14' ' ' TRP . 59.2 Cg_endo -68.08 150.59 77.49 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.131 2.554 . . . . 0.0 113.204 -173.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 73.46 9.96 78.55 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.188 0.899 . . . . 0.0 115.151 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.12 160.5 42.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.635 1.574 . . . . 0.0 112.248 -178.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -71.28 155.94 92.32 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.008 0.923 . . . . 0.0 111.743 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.36 126.95 22.24 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.871 2.381 . . . . 0.0 112.312 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -83.76 115.77 22.38 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.101 0.96 . . . . 0.0 110.973 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.48 130.93 35.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.247 0.619 . . . . 0.0 109.808 168.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -151.16 173.66 14.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.537 1.135 . . . . 0.0 110.998 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -126.79 114.23 17.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.21 1.004 . . . . 0.0 111.513 -173.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.7 mt -86.4 116.02 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 125.476 1.51 . . . . 0.0 109.744 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -82.51 117.84 22.81 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 167.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.0 -9.64 41.13 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -91.34 -19.89 22.44 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 170.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -87.16 148.58 45.32 Favored Pre-proline 0 N--CA 1.485 1.309 0 CA-C-N 120.225 1.375 . . . . 0.0 111.967 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.57 146.92 56.46 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.415 2.743 . . . . 0.0 112.577 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.84 -30.14 71.26 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 118.245 -0.883 . . . . 0.0 113.103 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.2 t -58.92 -45.23 90.83 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.991 1.269 . . . . 0.0 111.61 173.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.23 95.33 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.765 -0.584 . . . . 0.0 112.26 175.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 60.6 mt -60.9 -51.91 67.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.683 0.793 . . . . 0.0 111.251 175.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.4 mt -61.57 -39.83 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 123.943 0.897 . . . . 0.0 110.017 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -58.57 -43.61 89.45 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.758 0.708 . . . . 0.0 112.368 171.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -69.91 -26.33 64.11 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.565 1.146 . . . . 0.0 112.903 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.6 t -71.0 -61.39 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.919 0.888 . . . . 0.0 110.093 169.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -55.37 -39.2 69.82 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.56 1.544 . . . . 0.0 113.764 -173.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.87 -29.77 68.53 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.56 -29.79 72.94 Favored Glycine 0 CA--C 1.534 1.257 0 O-C-N 121.291 -0.881 . . . . 0.0 113.897 177.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -99.22 14.03 30.91 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.192 1.397 . . . . 0.0 112.883 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p 57.67 20.68 6.56 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.467 2.307 . . . . 0.0 115.322 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -72.39 113.42 9.42 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.877 1.271 . . . . 0.0 110.889 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.18 162.99 28.39 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.308 1.043 . . . . 0.0 112.207 174.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.5 m120 54.16 65.26 1.56 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.724 1.609 . . . . 0.0 112.777 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 32.3 p-80 -62.77 -14.34 43.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.353 1.061 . . . . 0.0 113.333 -177.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -54.57 -29.48 51.38 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.274 1.83 . . . . 0.0 113.407 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -74.98 -21.22 59.28 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.545 1.138 . . . . 0.0 112.86 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -98.24 160.01 14.57 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -168.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.24 156.42 39.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.305 2.242 . . . . 0.0 110.137 169.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.7 mt -80.32 154.53 27.73 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 167.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -142.17 144.8 33.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.655 1.182 . . . . 0.0 110.372 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -63.05 139.87 58.82 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.98 -23.94 6.72 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.92 1.288 . . . . 0.0 112.88 170.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -73.02 -6.35 44.92 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.609 1.164 . . . . 0.0 113.946 169.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.9 t -146.3 -166.25 2.42 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.036 1.734 . . . . 0.0 110.796 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 71.3 m -60.49 165.35 3.77 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.198 0.999 . . . . 0.0 112.113 170.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -71.35 45.11 0.1 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.569 1.948 . . . . 0.0 115.198 -171.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -67.96 118.49 11.22 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.59 -1.319 . . . . 0.0 110.857 173.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -67.67 141.67 56.61 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.866 0.467 . . . . 0.0 109.958 169.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mm -80.14 135.65 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.849 0.859 . . . . 0.0 110.409 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -143.78 168.93 18.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.15 2.18 . . . . 0.0 108.86 -177.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -61.3 -15.55 36.63 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.367 -0.833 . . . . 0.0 113.229 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -87.99 -50.4 6.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.321 1.448 . . . . 0.0 112.082 168.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -77.22 -19.63 56.41 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.992 1.317 . . . . 0.0 114.375 -168.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -58.32 -17.91 23.39 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -66.23 -19.21 65.76 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 173.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -75.43 -16.14 60.37 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.134 0.974 . . . . 0.0 113.113 173.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.9 mt -75.67 128.65 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 123.967 0.907 . . . . 0.0 109.688 177.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -120.6 168.38 11.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.255 1.822 . . . . 0.0 111.842 171.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -61.16 121.96 13.84 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.613 -0.679 . . . . 0.0 111.312 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.23 10.19 62.61 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.438 1.494 . . . . 0.0 115.594 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.0 m -64.81 131.33 46.5 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 119.692 1.746 . . . . 0.0 111.861 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 43.7 mt -87.2 125.9 40.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.85 0.86 . . . . 0.0 109.784 169.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.1 mt -124.79 176.75 6.39 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.877 2.471 . . . . 0.0 109.924 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt85 -136.61 149.07 47.81 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.846 1.259 . . . . 0.0 110.814 168.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.2 tp -82.98 138.81 33.63 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.52 156.53 32.19 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.165 0.986 . . . . 0.0 110.67 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 26.8 p -70.63 132.44 45.45 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.62 -1.3 . . . . 0.0 110.418 169.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 p -68.47 164.78 41.13 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 125.339 1.456 . . . . 0.0 112.498 -176.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.85 -25.43 9.08 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 122.534 2.156 . . . . 0.0 113.281 172.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.97 -41.17 10.16 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.586 1.154 . . . . 0.0 113.974 -174.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 49.57 -117.41 0.99 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.216 1.807 . . . . 0.0 112.488 178.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -102.65 9.31 39.35 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.401 1.48 . . . . 0.0 113.8 -175.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.76 124.55 23.61 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.259 -0.9 . . . . 0.0 112.376 -177.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 60.12 163.93 0.06 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 127.327 2.251 . . . . 0.0 115.173 -175.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -69.99 136.84 50.88 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.11 -0.994 . . . . 0.0 110.958 172.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.3 mp -73.92 151.81 40.29 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.156 0.983 . . . . 0.0 112.097 179.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.422 ' CE1' ' HE ' ' A' ' 91' ' ' ARG . 5.7 p80 -151.09 147.32 26.93 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.746 1.618 . . . . 0.0 111.439 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.57 34.76 0.59 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.04 1.336 . . . . 0.0 113.145 -176.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.422 ' HE ' ' CE1' ' A' ' 89' ' ' HIS . 37.2 ttm-85 -62.24 -15.69 48.69 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 127.045 2.138 . . . . 0.0 115.021 -171.18 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.7 pt -70.2 -13.58 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.932 1.693 . . . . 0.0 113.817 173.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -63.52 148.37 48.91 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.146 0.978 . . . . 0.0 113.054 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.2 t -158.83 150.93 21.23 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.989 1.316 . . . . 0.0 111.903 177.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.7 m -75.32 -13.75 60.44 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.539 1.135 . . . . 0.0 113.363 169.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 86.3 p -72.25 161.76 30.41 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.615 1.166 . . . . 0.0 113.437 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -150.56 156.12 40.77 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.553 1.541 . . . . 0.0 111.461 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -140.07 11.06 2.39 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.991 1.316 . . . . 0.0 114.151 -176.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -151.51 155.79 39.23 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.377 1.471 . . . . 0.0 112.193 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -130.13 26.31 5.18 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 126.107 1.763 . . . . 0.0 112.724 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.6 mt -79.58 -5.52 55.13 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.631 1.572 . . . . 0.0 114.751 -171.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -63.22 137.21 58.13 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.23 1.012 . . . . 0.0 112.789 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.48 147.13 46.36 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.951 0.901 . . . . 0.0 112.706 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -116.89 9.2 13.74 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.484 1.514 . . . . 0.0 113.374 -179.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -67.34 136.22 54.49 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.128 1.371 . . . . 0.0 112.154 -176.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -84.42 147.28 27.2 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.54 1.136 . . . . 0.0 111.721 173.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.6 mp -103.73 -18.46 14.68 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.626 1.57 . . . . 0.0 112.787 174.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -77.7 169.1 18.88 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.526 1.13 . . . . 0.0 112.95 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.9 t -148.64 146.64 28.28 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.21 1.404 . . . . 0.0 111.92 176.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.6 -3.18 52.66 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.944 1.298 . . . . 0.0 113.943 173.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 23.7 t -65.83 136.25 55.92 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.012 0.925 . . . . 0.0 112.341 -179.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.66 153.27 35.34 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.009 1.324 . . . . 0.0 112.738 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.9 t0 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 126.018 1.727 . . . . 0.0 112.814 175.285 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.638 0 N-CA-C 111.948 -0.461 . . . . 0.0 111.948 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.1 mtp -70.41 155.99 92.58 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.117 0.967 . . . . 0.0 112.526 177.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -53.36 121.71 9.93 Favored 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 124.092 3.195 . . . . 0.0 112.923 175.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -67.87 145.76 69.59 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 122.606 2.204 . . . . 0.0 113.878 -175.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -65.71 146.98 85.36 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 122.991 2.46 . . . . 0.0 112.206 176.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 60.16 0.7 0.3 Allowed 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -92.25 14.36 16.5 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.677 1.591 . . . . 0.0 112.693 169.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.0 mt -129.15 136.74 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.587 1.555 . . . . 0.0 110.15 -170.012 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 10.3 m -129.79 127.47 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.19 1.396 . . . . 0.0 111.594 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -75.83 141.56 42.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.006 0.922 . . . . 0.0 111.03 175.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -140.68 156.83 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.498 1.519 . . . . 0.0 111.936 -176.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.28 116.24 26.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.789 1.235 . . . . 0.0 109.945 170.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.71 126.1 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 124.303 1.041 . . . . 0.0 110.568 -171.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -84.56 146.92 27.29 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.262 1.425 . . . . 0.0 113.147 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -153.34 142.18 14.43 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 125.941 1.696 . . . . 0.0 110.167 169.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -62.07 138.67 74.33 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.66 2.24 . . . . 0.0 113.592 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.73 13.21 71.58 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.355 0.902 . . . . 0.0 115.355 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.8 154.22 50.6 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.263 1.425 . . . . 0.0 112.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -68.56 148.35 98.1 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 123.522 0.729 . . . . 0.0 111.059 170.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.34 129.91 33.5 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.548 2.165 . . . . 0.0 113.064 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -81.08 111.62 17.7 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.64 1.176 . . . . 0.0 110.347 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -77.03 127.51 32.81 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.328 0.651 . . . . 0.0 109.651 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -154.86 178.18 10.45 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.014 0.925 . . . . 0.0 111.833 173.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -115.8 136.44 53.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.453 1.101 . . . . 0.0 111.924 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.0 mt -105.1 107.43 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 125.794 1.637 . . . . 0.0 108.225 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -78.34 117.04 19.2 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 168.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -67.07 -13.39 61.88 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -87.36 -21.96 25.35 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.188 0.995 . . . . 0.0 113.681 173.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -75.99 148.35 81.49 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 124.469 1.108 . . . . 0.0 111.852 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.02 139.34 42.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.978 2.452 . . . . 0.0 111.04 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.4 mt -61.44 -31.13 71.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.35 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.7 t -60.02 -44.51 94.56 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.56 1.073 . . . . 0.0 112.291 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -39.84 93.5 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.659 -0.651 . . . . 0.0 112.026 175.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.5 mt -65.03 -46.49 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.166 0.586 . . . . 0.0 110.619 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.1 mt -60.26 -38.2 76.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.658 1.183 . . . . 0.0 111.138 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -61.69 -40.15 93.97 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.4 0.68 . . . . 0.0 112.316 172.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -69.31 -25.66 64.34 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.396 1.078 . . . . 0.0 113.167 173.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.35 -58.99 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.438 1.017 . . . . 0.0 110.564 169.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.3 p -65.08 -35.05 79.92 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.238 0.615 . . . . 0.0 112.348 -169.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.53 -29.0 68.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.055 0.942 . . . . 0.0 112.922 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -22.98 68.47 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.421 1.01 . . . . 0.0 114.263 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -115.48 10.71 15.78 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.022 1.729 . . . . 0.0 113.053 172.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.1 t 54.96 31.1 15.29 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.049 1.74 . . . . 0.0 114.169 -175.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.41 125.42 29.51 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.707 1.203 . . . . 0.0 109.908 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.83 159.23 30.24 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 113.586 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 51.6 75.78 0.19 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.081 2.153 . . . . 0.0 113.325 170.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -62.33 -17.82 59.81 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.485 1.114 . . . . 0.0 113.661 -173.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -55.31 -30.88 61.07 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.224 1.41 . . . . 0.0 112.68 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -73.55 -23.49 59.98 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.155 0.582 . . . . 0.0 112.22 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -94.85 158.03 15.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.801 1.24 . . . . 0.0 114.331 -169.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.71 148.41 35.66 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.731 2.013 . . . . 0.0 109.748 169.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.29 148.33 35.76 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 167.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -141.39 153.99 45.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.344 1.458 . . . . 0.0 109.375 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -68.72 148.47 50.33 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.314 -0.866 . . . . 0.0 112.427 171.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.22 -25.56 4.84 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.317 1.447 . . . . 0.0 111.265 167.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -62.92 -49.76 73.5 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.617 0.767 . . . . 0.0 109.227 167.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.9 t -88.58 155.24 19.74 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.523 1.129 . . . . 0.0 109.161 165.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.0 m -60.59 -48.94 79.56 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -168.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -155.06 13.7 0.39 Allowed 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 -169.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.2 m-30 -66.27 118.29 9.75 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 120.084 1.311 . . . . 0.0 111.476 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -70.89 145.83 49.96 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.421 -0.799 . . . . 0.0 111.553 172.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.82 131.15 34.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.096 0.958 . . . . 0.0 110.238 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -146.9 169.48 19.07 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.155 1.782 . . . . 0.0 110.102 -176.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -60.03 -18.0 43.03 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.734 -1.229 . . . . 0.0 113.458 172.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -96.0 -8.06 34.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.988 1.715 . . . . 0.0 114.296 175.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -133.69 -13.28 2.58 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 -172.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -59.95 -23.31 63.46 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 120.581 -1.324 . . . . 0.0 114.105 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -61.78 -22.69 65.65 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.394 1.478 . . . . 0.0 113.279 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -73.75 -19.55 60.75 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.641 0.777 . . . . 0.0 112.863 177.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 51.3 mt -68.76 132.71 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.97 0.908 . . . . 0.0 109.603 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -135.48 165.51 25.34 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.651 1.98 . . . . 0.0 111.882 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -57.62 116.04 3.15 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.332 0.653 . . . . 0.0 111.362 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.15 11.58 56.03 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.59 1.567 . . . . 0.0 115.568 -176.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.9 m -65.85 133.12 50.28 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.606 1.703 . . . . 0.0 111.781 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -85.19 121.97 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 170.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -118.7 -179.89 3.94 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.734 2.013 . . . . 0.0 110.873 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -148.55 137.45 21.6 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 127.331 2.252 . . . . 0.0 110.256 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 tp -85.27 137.88 32.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.754 0.821 . . . . 0.0 109.993 169.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.2 t -157.19 151.86 25.5 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.812 0.845 . . . . 0.0 110.917 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.3 p -71.03 132.63 45.43 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.988 -1.07 . . . . 0.0 110.298 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.9 p -68.47 162.29 63.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.462 1.505 . . . . 0.0 114.199 -169.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -63.86 -28.59 67.51 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.551 2.167 . . . . 0.0 112.609 168.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.74 -37.96 70.5 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.195 1.398 . . . . 0.0 114.118 -173.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -66.04 -11.43 48.29 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -176.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -68.67 -11.76 60.56 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.227 1.011 . . . . 0.0 113.501 170.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.36 -176.56 4.57 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.336 1.855 . . . . 0.0 111.767 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -71.86 8.95 1.02 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 126.003 1.721 . . . . 0.0 114.363 179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -77.3 46.16 0.5 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.676 1.99 . . . . 0.0 113.339 -176.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.4 mp -67.99 149.72 49.37 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.971 1.308 . . . . 0.0 111.432 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -73.0 153.04 41.09 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.512 1.125 . . . . 0.0 113.522 -174.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -152.22 157.5 41.54 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.509 1.524 . . . . 0.0 110.408 169.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -79.33 67.91 5.19 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.511 1.124 . . . . 0.0 112.754 -173.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.8 mm -62.63 140.7 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.72 1.208 . . . . 0.0 110.02 169.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 33.1 tp60 -62.89 131.13 47.72 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.593 0.757 . . . . 0.0 111.964 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.1 t -154.78 154.76 33.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.676 1.59 . . . . 0.0 110.77 178.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 99.0 p -152.28 160.97 43.25 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.088 1.355 . . . . 0.0 112.111 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.4 t -153.73 138.68 17.22 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.866 1.266 . . . . 0.0 111.225 -177.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 51.3 tpp -81.17 148.51 29.52 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.683 1.193 . . . . 0.0 111.953 175.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -66.79 149.2 50.89 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.983 0.913 . . . . 0.0 112.218 175.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -126.73 28.85 5.8 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.542 1.537 . . . . 0.0 112.542 -176.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -54.38 123.11 11.95 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.836 1.654 . . . . 0.0 111.83 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.4 tp -157.69 140.86 15.26 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.702 1.601 . . . . 0.0 110.585 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -69.93 131.08 43.87 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.5 0.72 . . . . 0.0 111.38 174.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -153.52 156.9 38.94 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.518 1.127 . . . . 0.0 112.792 -174.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.2 mt -137.67 160.39 39.34 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.439 1.895 . . . . 0.0 111.18 178.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -144.22 143.48 31.07 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.76 1.624 . . . . 0.0 110.835 178.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 20.1 p-10 -83.02 75.77 9.88 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.879 1.672 . . . . 0.0 111.546 174.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.41 153.83 30.11 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.003 0.921 . . . . 0.0 111.985 175.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.88 -22.07 63.92 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.2 p -64.4 -18.53 64.79 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.274 1.43 . . . . 0.0 114.182 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.97 -20.14 59.79 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.861 0.864 . . . . 0.0 112.665 172.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 24.1 t -66.85 132.95 49.07 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.794 0.838 . . . . 0.0 111.512 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -159.06 157.26 30.77 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.464 1.505 . . . . 0.0 112.658 -169.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.088 1.755 . . . . 0.0 113.15 175.892 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.559 0 N-CA-C 111.975 -0.45 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt 51.35 66.99 4.63 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.369 1.868 . . . . 0.0 113.862 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -67.88 166.23 25.26 Favored 'Trans proline' 0 CA--C 1.548 1.194 0 C-N-CA 123.475 2.783 . . . . 0.0 112.75 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -58.5 158.51 23.03 Favored 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 123.632 2.888 . . . . 0.0 113.855 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -56.72 136.78 78.17 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.68 2.92 . . . . 0.0 114.222 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -80.27 74.81 7.08 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.901 1.28 . . . . 0.0 111.751 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -73.43 33.86 0.08 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 125.993 1.717 . . . . 0.0 114.282 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.5 mt -81.16 138.81 19.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 125.673 1.589 . . . . 0.0 109.746 176.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 m -129.44 132.17 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.937 1.295 . . . . 0.0 112.01 -177.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -69.15 146.42 52.49 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.761 0.824 . . . . 0.0 110.756 170.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m -143.69 151.58 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.408 1.483 . . . . 0.0 111.521 176.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.87 116.75 28.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.665 1.186 . . . . 0.0 109.854 173.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.7 mt -106.7 123.96 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.907 0.883 . . . . 0.0 110.823 -169.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -82.7 144.69 30.06 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.236 1.414 . . . . 0.0 112.933 174.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -154.83 143.44 14.67 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 126.003 1.721 . . . . 0.0 110.079 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -63.02 143.21 90.46 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.605 2.203 . . . . 0.0 113.789 -173.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.5 12.27 73.2 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 178.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.91 155.79 45.5 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.181 1.392 . . . . 0.0 112.702 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -69.47 152.86 96.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 123.803 0.841 . . . . 0.0 111.371 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.99 128.9 29.52 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.596 2.198 . . . . 0.0 113.17 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -78.29 111.32 14.14 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.623 1.169 . . . . 0.0 110.148 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.3 127.67 32.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.316 0.646 . . . . 0.0 109.584 169.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.4 ptm -152.63 -178.52 6.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.035 0.934 . . . . 0.0 111.67 172.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -122.44 129.64 52.26 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.49 1.116 . . . . 0.0 111.572 178.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.2 mt -96.26 112.87 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 C-N-CA 125.311 1.444 . . . . 0.0 108.664 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.99 120.47 26.15 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 167.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -64.92 -11.09 34.28 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -87.22 -21.9 25.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.944 1.298 . . . . 0.0 114.345 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -77.97 141.87 63.88 Favored Pre-proline 0 N--CA 1.483 1.191 0 CA-C-N 119.831 1.196 . . . . 0.0 111.513 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.19 144.22 56.32 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.333 2.688 . . . . 0.0 111.543 177.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.1 mt -63.72 -29.97 71.13 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.071 -0.966 . . . . 0.0 113.097 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.0 t -61.13 -44.82 96.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.397 1.453 . . . . 0.0 111.898 174.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.11 95.52 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.567 -0.708 . . . . 0.0 112.194 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.12 -50.41 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.399 0.679 . . . . 0.0 110.502 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.01 -35.66 69.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.299 1.04 . . . . 0.0 110.946 -179.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.02 -43.33 95.34 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.041 0.837 . . . . 0.0 112.081 170.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -68.74 -29.69 68.16 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.732 1.213 . . . . 0.0 113.121 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.16 -53.66 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 121.292 -0.88 . . . . 0.0 110.155 169.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.0 m -61.4 -43.73 98.37 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.161 0.984 . . . . 0.0 111.986 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -60.34 -29.72 69.07 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.098 0.959 . . . . 0.0 112.847 175.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.32 -23.58 62.45 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.395 0.998 . . . . 0.0 114.436 173.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.71 16.86 14.45 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.97 1.708 . . . . 0.0 113.25 171.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.0 p 56.33 21.02 5.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.281 2.232 . . . . 0.0 115.536 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -68.41 123.92 22.1 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.447 1.499 . . . . 0.0 111.423 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.89 158.73 31.72 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.445 1.098 . . . . 0.0 112.365 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 50.52 68.41 0.77 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.491 1.916 . . . . 0.0 112.998 173.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -62.2 -15.72 48.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.558 1.143 . . . . 0.0 113.158 -177.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -55.99 -26.92 50.59 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.754 1.622 . . . . 0.0 113.197 176.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -77.77 -15.9 58.77 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -98.18 157.65 16.03 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -168.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.65 149.24 35.35 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 127.297 2.239 . . . . 0.0 109.53 169.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -78.39 157.16 29.14 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -145.85 147.82 32.22 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.792 1.237 . . . . 0.0 110.157 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -65.19 125.98 26.69 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.629 -0.669 . . . . 0.0 110.906 173.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.79 -27.41 50.16 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -171.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -77.89 69.69 4.16 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.085 1.354 . . . . 0.0 112.811 -170.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.5 p 60.22 -14.81 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 129.294 3.038 . . . . 0.0 117.198 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.4 t -66.72 148.28 52.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.514 1.526 . . . . 0.0 113.282 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.2 p-10 -87.01 -5.54 59.04 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.432 1.093 . . . . 0.0 113.608 170.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -63.55 107.1 1.06 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.511 1.051 . . . . 0.0 112.861 -169.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -70.05 146.35 51.04 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.755 0.822 . . . . 0.0 110.005 168.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.1 mm -80.6 136.64 22.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.115 0.966 . . . . 0.0 110.083 175.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.0 p -144.43 169.51 17.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.236 2.214 . . . . 0.0 108.553 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -62.19 -11.78 16.41 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 177.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.76 -44.97 6.85 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.352 1.461 . . . . 0.0 112.509 168.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -76.25 -21.64 56.11 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.486 1.114 . . . . 0.0 113.509 -172.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -57.15 -22.23 38.63 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 176.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -66.86 -18.51 65.41 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.401 1.081 . . . . 0.0 113.377 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -79.83 -11.26 59.83 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.288 1.035 . . . . 0.0 113.452 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.4 mt -76.14 133.03 31.99 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.311 1.044 . . . . 0.0 109.651 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.75 166.89 15.39 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.724 2.01 . . . . 0.0 111.804 173.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -60.65 118.89 7.13 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.823 -0.548 . . . . 0.0 111.41 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.16 14.34 56.17 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 125.293 1.425 . . . . 0.0 115.436 -175.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -65.33 130.62 43.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.77 1.785 . . . . 0.0 111.28 177.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mt -84.29 121.92 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 170.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -117.88 174.62 6.08 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.255 1.822 . . . . 0.0 110.671 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -141.92 133.84 27.33 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 126.239 1.816 . . . . 0.0 109.976 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 tp -79.47 136.8 37.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.194 0.598 . . . . 0.0 110.138 170.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.3 t -157.53 151.0 23.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.421 1.088 . . . . 0.0 110.11 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.9 p -72.0 138.57 48.06 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.493 -1.38 . . . . 0.0 110.388 169.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p -65.93 162.23 47.45 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 123.954 0.902 . . . . 0.0 112.234 -175.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -56.49 -24.38 52.67 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.302 2.668 . . . . 0.0 115.053 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -104.08 -4.93 22.6 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.546 1.538 . . . . 0.0 114.173 176.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 49.91 38.04 15.16 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.873 1.669 . . . . 0.0 112.789 -168.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -148.61 164.85 33.03 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.639 2.376 . . . . 0.0 110.242 -177.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.55 -34.14 75.06 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -176.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -80.23 111.04 16.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.075 0.95 . . . . 0.0 109.334 168.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.3 pm0 -73.92 -19.91 60.54 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.9 135.52 33.28 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.236 1.414 . . . . 0.0 112.952 -177.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 27.2 p80 -84.48 -10.27 57.62 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.799 1.24 . . . . 0.0 113.513 169.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -65.5 145.5 56.03 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.177 1.391 . . . . 0.0 113.175 -177.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -135.38 136.17 41.24 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.13 1.772 . . . . 0.0 111.231 -178.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 99.5 mt -77.55 -46.11 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.126 0.971 . . . . 0.0 111.619 -176.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -151.99 149.38 28.82 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.648 1.179 . . . . 0.0 112.705 -177.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 87.7 p -75.03 171.74 13.57 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.611 1.564 . . . . 0.0 113.195 175.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.6 t -145.43 156.47 43.77 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.642 1.577 . . . . 0.0 111.052 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 80.1 p -67.76 -31.25 71.03 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.185 0.994 . . . . 0.0 113.124 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 78.1 mtm -147.28 108.72 4.3 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.633 1.573 . . . . 0.0 111.27 176.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -76.45 -32.78 58.62 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.276 0.63 . . . . 0.0 112.119 169.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.43 60.77 2.68 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.823 1.649 . . . . 0.0 112.285 178.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -58.19 -25.03 61.08 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.224 1.41 . . . . 0.0 114.364 -176.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -76.1 -10.22 59.24 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.373 1.869 . . . . 0.0 115.048 176.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -68.2 142.04 55.8 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.314 0.961 . . . . 0.0 112.913 -177.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -148.63 164.16 35.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.737 1.615 . . . . 0.0 111.719 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.72 159.97 43.62 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.568 1.547 . . . . 0.0 112.088 -177.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -71.57 155.19 40.83 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.796 1.239 . . . . 0.0 112.53 178.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -69.18 157.24 37.28 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.241 1.016 . . . . 0.0 112.378 171.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 pp -147.69 166.96 25.88 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.34 1.456 . . . . 0.0 112.191 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -148.03 166.66 27.08 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.67 1.588 . . . . 0.0 111.888 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.3 t -148.39 160.24 43.22 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.779 1.231 . . . . 0.0 112.572 -177.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.4 mt -76.13 -5.57 47.23 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.257 1.423 . . . . 0.0 113.405 173.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 91.5 p -69.56 -14.56 62.91 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.197 1.399 . . . . 0.0 114.554 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -64.52 150.07 47.43 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.665 1.586 . . . . 0.0 112.628 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.0 t0 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 125.899 1.679 . . . . 0.0 112.906 176.077 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.604 0 N-CA-C 112.066 -0.414 . . . . 0.0 112.066 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.0 ptm -66.26 151.25 96.08 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 124.095 0.958 . . . . 0.0 112.774 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.73 153.05 76.95 Favored 'Trans proline' 0 CA--C 1.546 1.122 0 C-N-CA 122.906 2.404 . . . . 0.0 112.206 173.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -70.29 155.74 63.5 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.371 2.714 . . . . 0.0 112.648 177.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -69.15 162.19 42.76 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.596 2.864 . . . . 0.0 112.462 173.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -146.69 153.59 40.45 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.129 1.371 . . . . 0.0 112.077 177.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 51.2 p-10 -106.11 9.32 32.38 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.09 1.756 . . . . 0.0 114.037 -177.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.1 mt -71.04 137.32 24.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.95 1.3 . . . . 0.0 109.243 174.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 m -129.02 123.3 58.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.484 1.114 . . . . 0.0 112.745 -173.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -72.86 137.72 45.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.37 1.468 . . . . 0.0 111.261 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.7 m -139.34 157.01 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.511 1.524 . . . . 0.0 111.956 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.54 118.47 32.73 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.817 1.247 . . . . 0.0 109.837 171.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.5 mt -106.03 123.97 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.805 0.842 . . . . 0.0 110.882 -171.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -85.53 143.57 28.43 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.062 1.745 . . . . 0.0 113.025 176.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -156.46 142.09 12.7 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.086 1.754 . . . . 0.0 110.1 169.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -59.12 145.88 96.25 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.999 2.466 . . . . 0.0 114.493 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.1 11.46 74.89 Favored Glycine 0 CA--C 1.539 1.56 0 N-CA-C 115.607 1.003 . . . . 0.0 115.607 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -144.72 158.6 43.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.104 1.361 . . . . 0.0 112.695 -177.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -70.65 155.42 93.42 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.012 0.925 . . . . 0.0 111.662 170.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -60.65 130.18 32.31 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.653 2.235 . . . . 0.0 112.732 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -82.74 108.74 16.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.354 1.061 . . . . 0.0 110.453 176.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.7 mt -76.4 128.03 34.03 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 110.17 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -155.3 175.37 13.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.411 1.084 . . . . 0.0 111.638 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -122.71 118.32 27.81 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.383 1.073 . . . . 0.0 111.584 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.8 mt -83.79 110.54 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 125.227 1.411 . . . . 0.0 108.848 175.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -81.95 116.48 21.6 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 169.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.68 -12.71 55.92 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.0 -26.63 26.97 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.35 0.977 . . . . 0.0 113.489 171.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -77.45 142.48 67.06 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.02 0.928 . . . . 0.0 111.396 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.22 143.15 63.48 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.12 2.547 . . . . 0.0 111.296 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.2 mt -60.69 -31.39 70.64 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.442 178.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.8 p -59.18 -45.4 91.12 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.597 1.09 . . . . 0.0 112.45 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.77 89.48 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.178 0.591 . . . . 0.0 112.109 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.73 -47.54 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.647 0.779 . . . . 0.0 110.843 177.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.52 -37.73 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.589 1.156 . . . . 0.0 110.761 178.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -62.93 -38.47 91.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 172.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -71.02 -23.94 62.27 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.262 1.025 . . . . 0.0 113.074 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 73.2 t -73.14 -62.32 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 O-C-N 121.107 -0.996 . . . . 0.0 111.005 169.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.8 p -59.74 -30.98 69.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.94 1.296 . . . . 0.0 113.652 -169.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.85 -28.38 67.47 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.573 1.149 . . . . 0.0 113.346 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.68 -26.08 74.83 Favored Glycine 0 CA--C 1.534 1.232 0 O-C-N 121.332 -0.855 . . . . 0.0 114.011 177.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.0 m0 -107.67 11.09 28.77 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.668 1.587 . . . . 0.0 112.84 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.8 m 55.41 29.23 12.77 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.157 1.783 . . . . 0.0 114.065 -176.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -80.51 121.01 25.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.602 1.161 . . . . 0.0 110.332 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.7 165.85 23.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.78 1.232 . . . . 0.0 113.214 -178.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 54.15 63.75 2.07 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.037 1.735 . . . . 0.0 113.417 173.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -59.77 -21.8 61.26 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.958 0.903 . . . . 0.0 113.35 -176.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -55.95 -28.92 59.14 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.211 1.405 . . . . 0.0 113.127 172.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -77.77 -16.81 58.12 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.785 0.834 . . . . 0.0 112.624 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -96.99 159.64 14.79 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -169.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.27 156.35 43.31 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.152 2.581 . . . . 0.0 109.78 171.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.0 mt -89.5 156.02 18.91 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 166.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -148.25 147.34 29.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.979 0.912 . . . . 0.0 110.998 -177.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 52.2 m-70 -65.9 130.53 43.58 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.336 0.654 . . . . 0.0 112.036 174.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.75 2.55 50.91 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.321 1.048 . . . . 0.0 113.198 169.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -65.89 179.96 0.81 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.656 1.982 . . . . 0.0 112.842 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -58.09 -11.58 2.67 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.017 1.727 . . . . 0.0 115.269 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.0 t -136.57 129.17 30.45 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.241 1.416 . . . . 0.0 110.164 168.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -90.51 60.15 4.52 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.246 1.418 . . . . 0.0 112.59 -169.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -64.32 134.38 54.54 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.434 -0.791 . . . . 0.0 111.164 172.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -71.77 145.92 48.41 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 121.682 -0.636 . . . . 0.0 110.93 169.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mm -82.14 130.22 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 123.988 0.915 . . . . 0.0 109.545 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.5 p -143.69 166.77 23.94 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.786 1.634 . . . . 0.0 109.78 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.57 -13.16 27.97 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.853 -1.154 . . . . 0.0 113.345 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -97.91 -13.59 21.12 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.123 1.769 . . . . 0.0 114.417 173.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -126.3 -11.74 6.31 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -60.74 -18.88 57.38 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -62.4 -22.13 65.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.807 1.243 . . . . 0.0 113.112 174.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -75.02 -13.15 60.47 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.062 0.945 . . . . 0.0 113.357 177.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 65.3 mt -73.37 134.48 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.321 1.049 . . . . 0.0 110.079 175.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -126.85 166.38 17.57 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.227 1.811 . . . . 0.0 111.442 174.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -56.92 125.09 20.96 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.761 -0.587 . . . . 0.0 111.321 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.7 9.29 68.89 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.238 1.399 . . . . 0.0 115.343 -176.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 99.0 m -66.0 130.07 41.99 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.498 1.649 . . . . 0.0 111.255 177.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.8 mt -87.0 124.77 40.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 170.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.4 mt -118.21 172.46 7.42 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.239 1.815 . . . . 0.0 110.723 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.7 ttt-85 -132.11 140.38 48.79 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 126.745 2.018 . . . . 0.0 110.049 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.96 140.19 38.07 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 167.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -158.25 152.84 24.69 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.308 -0.87 . . . . 0.0 111.028 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.1 p -73.6 135.15 43.83 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.568 -1.332 . . . . 0.0 110.856 170.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.3 t -71.46 145.71 90.68 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 126.434 1.893 . . . . 0.0 114.421 -168.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.23 -16.94 53.57 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.592 2.194 . . . . 0.0 112.665 168.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.28 12.88 14.82 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.787 1.635 . . . . 0.0 114.733 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -57.26 152.32 14.17 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.054 -1.029 . . . . 0.0 112.873 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -143.21 138.29 29.58 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.527 1.531 . . . . 0.0 110.652 -177.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.19 -14.86 61.44 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.707 1.203 . . . . 0.0 114.115 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -58.3 132.02 52.37 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.9 1.28 . . . . 0.0 112.252 177.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -72.36 142.25 48.77 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.099 0.96 . . . . 0.0 111.685 174.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.9 mt -130.81 165.99 21.8 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.251 1.821 . . . . 0.0 112.003 -174.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 35.6 p80 -143.4 163.07 34.08 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.679 1.592 . . . . 0.0 111.732 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -154.1 168.11 27.58 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.946 1.298 . . . . 0.0 112.608 -175.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -138.06 138.18 38.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.376 1.87 . . . . 0.0 110.371 173.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 99.0 mt -72.33 124.94 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.993 0.917 . . . . 0.0 110.227 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 66.8 tp60 -79.96 130.5 35.33 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.428 1.091 . . . . 0.0 111.286 174.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 34.5 t -72.94 135.27 45.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.517 0.727 . . . . 0.0 111.363 171.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 25.4 t -159.94 152.47 21.1 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.926 1.29 . . . . 0.0 111.81 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.0 m -142.89 139.96 31.01 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.677 1.591 . . . . 0.0 111.097 177.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.9 ptm -158.35 172.66 17.96 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.287 1.435 . . . . 0.0 112.034 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 56.2 p30 -135.33 164.98 26.52 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.87 1.668 . . . . 0.0 111.74 170.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -154.6 166.13 34.33 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.075 1.35 . . . . 0.0 112.365 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -62.77 146.11 53.27 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.866 1.267 . . . . 0.0 111.518 173.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.4 mt -64.73 148.28 51.44 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.355 1.062 . . . . 0.0 112.672 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -72.36 158.58 35.52 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.579 1.152 . . . . 0.0 113.703 177.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -142.61 160.92 39.36 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.273 1.829 . . . . 0.0 111.006 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.82 137.07 57.55 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.856 0.862 . . . . 0.0 112.336 -177.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -90.72 -8.08 50.81 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.921 1.288 . . . . 0.0 113.863 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -75.3 -8.79 57.6 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.269 1.428 . . . . 0.0 114.691 -172.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -77.49 46.88 0.55 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.109 1.764 . . . . 0.0 112.971 -175.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -77.76 -7.36 56.45 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.78 1.632 . . . . 0.0 114.2 175.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.8 m 64.53 160.64 0.11 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 127.448 2.299 . . . . 0.0 115.111 -173.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 57.0 tp -67.74 141.7 56.51 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.772 1.229 . . . . 0.0 112.021 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 56.7 p -62.13 146.08 51.55 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.711 1.204 . . . . 0.0 112.8 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -116.7 7.09 13.41 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.95 1.7 . . . . 0.0 114.03 -176.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 . . . . . 0 C--O 1.251 1.173 0 C-N-CA 125.58 1.552 . . . . 0.0 113.562 177.85 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 54.1 mt . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.6 m -131.94 129.9 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.029 1.331 . . . . 0.0 112.399 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -76.35 141.61 41.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.123 0.969 . . . . 0.0 111.264 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.87 156.11 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.753 1.621 . . . . 0.0 111.512 -177.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.89 121.58 41.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.669 1.188 . . . . 0.0 109.786 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.9 mt -109.68 125.42 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.224 1.01 . . . . 0.0 110.474 -170.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -81.55 148.28 29.23 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.167 1.387 . . . . 0.0 113.375 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -155.89 142.9 13.6 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.108 1.763 . . . . 0.0 110.093 168.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -60.56 140.14 89.67 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.756 2.304 . . . . 0.0 113.823 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.58 12.84 70.69 Favored Glycine 0 CA--C 1.539 1.577 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.96 153.58 48.2 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.173 1.389 . . . . 0.0 112.611 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -69.59 150.07 96.86 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.492 0.717 . . . . 0.0 110.936 169.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -59.66 131.07 38.11 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.39 2.06 . . . . 0.0 113.332 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -80.05 114.51 19.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.721 1.209 . . . . 0.0 110.429 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.36 129.96 35.59 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.282 0.633 . . . . 0.0 109.706 169.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 23.9 ptm -154.68 177.13 11.58 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.117 0.967 . . . . 0.0 111.689 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -119.3 124.03 45.67 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.23 1.012 . . . . 0.0 111.211 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.7 mt -90.72 110.06 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 125.531 1.532 . . . . 0.0 108.575 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.1 t0 -83.33 118.3 23.59 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.731 0.813 . . . . 0.0 109.774 169.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -65.47 -12.33 51.59 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.12 -25.19 29.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.597 1.089 . . . . 0.0 113.716 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -78.29 148.76 74.82 Favored Pre-proline 0 N--CA 1.48 1.042 0 C-N-CA 124.455 1.102 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.44 141.75 47.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.888 2.392 . . . . 0.0 110.963 173.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -61.49 -30.96 70.94 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 123.107 0.563 . . . . 0.0 112.293 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -59.45 -43.96 93.06 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.038 0.836 . . . . 0.0 112.53 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.76 81.4 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.944 -0.472 . . . . 0.0 111.985 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.06 -48.43 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.33 0.652 . . . . 0.0 110.432 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.39 -38.87 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.619 1.168 . . . . 0.0 111.051 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -59.68 -40.19 87.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.502 0.721 . . . . 0.0 112.174 171.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -71.72 -24.76 61.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.454 1.102 . . . . 0.0 113.618 174.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 23.1 t -68.93 -62.22 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.727 1.149 . . . . 0.0 110.615 169.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.1 p -64.66 -33.64 76.43 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.81 0.844 . . . . 0.0 112.659 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.76 -28.67 68.9 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.827 0.851 . . . . 0.0 112.873 172.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.79 -23.16 68.92 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.333 0.968 . . . . 0.0 114.163 174.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -114.18 12.07 17.68 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.94 1.696 . . . . 0.0 113.296 172.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.0 m 54.88 27.68 9.39 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.982 1.713 . . . . 0.0 114.479 -175.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.4 mt -76.81 127.49 32.85 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.133 1.373 . . . . 0.0 110.57 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.52 164.17 25.64 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.686 1.194 . . . . 0.0 113.462 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 53.64 68.23 0.88 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.313 1.845 . . . . 0.0 113.64 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -60.73 -21.95 63.49 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.072 -1.017 . . . . 0.0 113.496 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -54.98 -28.32 50.81 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 112.923 171.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -77.3 -18.33 57.6 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.399 1.08 . . . . 0.0 113.027 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -98.07 158.74 15.37 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -168.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.03 154.51 42.59 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.702 2.401 . . . . 0.0 110.061 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -87.3 150.49 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.42 0.629 . . . . 0.0 109.851 168.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -137.14 143.44 42.47 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.411 1.884 . . . . 0.0 109.181 -176.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 . . . . . 0 N--CA 1.471 0.6 0 C-N-CA 123.225 0.61 . . . . 0.0 110.543 171.734 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 mm -76.32 135.65 26.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.664 0.745 . . . . 0.0 110.797 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.4 p -143.3 173.7 11.37 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.586 2.355 . . . . 0.0 109.136 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -57.08 -22.53 40.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -90.0 -52.89 4.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.436 . . . . 0.0 112.161 169.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.7 -17.04 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -171.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.31 -28.08 40.0 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.521 1.128 . . . . 0.0 113.665 169.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -72.48 -15.93 61.8 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.203 1.001 . . . . 0.0 113.442 177.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.83 -14.14 59.42 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.902 0.881 . . . . 0.0 112.945 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.3 mt -74.8 134.0 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 124.556 1.143 . . . . 0.0 110.016 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 168.02 14.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.713 2.005 . . . . 0.0 112.28 174.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.76 123.76 18.43 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.69 -0.631 . . . . 0.0 111.176 174.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.53 34.15 36.57 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.1 0.857 . . . . 0.0 114.084 -172.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.0 m -79.06 132.45 36.62 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.168 1.484 . . . . 0.0 110.716 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mt -86.44 113.21 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.6 mt -109.0 177.18 4.84 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.123 1.769 . . . . 0.0 110.869 176.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.6 ttt85 -145.64 137.93 25.6 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.56 1.944 . . . . 0.0 110.294 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 tp -82.69 136.98 34.59 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.557 0.743 . . . . 0.0 110.06 171.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.8 t -156.84 152.32 26.7 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.049 0.94 . . . . 0.0 110.834 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.7 p -72.14 135.29 46.14 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.714 -1.241 . . . . 0.0 110.976 172.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 CA--C 1.54 0.592 0 C-N-CA 125.322 1.449 . . . . 0.0 113.554 -170.541 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.3 mt . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 120.541 0.21 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.0 m -133.41 132.46 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.701 1.6 . . . . 0.0 112.068 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -75.74 138.43 41.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.305 1.042 . . . . 0.0 111.306 175.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m -139.92 157.56 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.351 1.461 . . . . 0.0 111.949 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -111.8 143.58 42.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.811 1.244 . . . . 0.0 109.708 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.6 mt -130.07 125.1 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.761 0.824 . . . . 0.0 110.622 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -86.63 144.81 26.99 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.587 1.555 . . . . 0.0 112.898 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -154.72 142.8 14.27 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 125.815 1.646 . . . . 0.0 110.415 169.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.34 140.28 75.98 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.733 2.288 . . . . 0.0 113.51 -174.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.77 14.08 69.74 Favored Glycine 0 CA--C 1.539 1.534 0 N-CA-C 115.31 0.884 . . . . 0.0 115.31 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.45 156.62 48.36 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.274 1.429 . . . . 0.0 112.805 -177.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -69.08 150.96 97.37 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.918 0.887 . . . . 0.0 111.396 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.17 125.88 18.08 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.792 2.328 . . . . 0.0 111.914 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -83.65 114.83 21.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.89 0.876 . . . . 0.0 110.523 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.6 mt -81.81 134.49 35.43 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.859 0.864 . . . . 0.0 109.815 169.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ppp? -158.36 178.98 9.57 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.575 1.15 . . . . 0.0 111.607 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -124.88 119.75 29.7 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.414 1.086 . . . . 0.0 111.309 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.1 mt -86.11 114.01 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 125.115 1.366 . . . . 0.0 109.085 174.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -88.8 117.24 27.64 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.004 0.922 . . . . 0.0 109.108 168.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -66.43 -14.47 62.22 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -88.12 -17.38 31.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.944 1.297 . . . . 0.0 113.906 172.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -79.32 147.01 67.82 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-N 119.628 1.103 . . . . 0.0 111.462 172.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.35 141.48 51.62 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.823 2.349 . . . . 0.0 111.086 175.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.96 -30.71 70.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.944 -0.551 . . . . 0.0 112.212 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m -59.92 -43.56 94.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.187 0.903 . . . . 0.0 112.734 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -39.32 79.71 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.793 -0.567 . . . . 0.0 111.975 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 83.8 mt -63.63 -48.45 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.503 0.721 . . . . 0.0 110.438 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.1 mt -61.58 -38.49 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.334 1.053 . . . . 0.0 110.768 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.06 -42.6 90.71 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 119.066 0.848 . . . . 0.0 112.146 170.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -69.01 -30.07 68.38 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.364 1.066 . . . . 0.0 112.974 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.49 -53.51 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 121.46 -0.775 . . . . 0.0 110.612 169.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -60.83 -43.49 98.19 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.776 0.83 . . . . 0.0 112.072 -176.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.88 -29.93 69.85 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.074 0.949 . . . . 0.0 112.891 175.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.99 -23.93 64.29 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.365 0.984 . . . . 0.0 114.295 174.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.4 m0 -115.57 14.21 16.51 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.907 1.683 . . . . 0.0 113.234 172.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.85 28.09 11.93 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.056 1.742 . . . . 0.0 114.346 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.1 mt -74.25 122.99 23.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.029 1.331 . . . . 0.0 111.283 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.56 164.56 26.44 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.489 1.116 . . . . 0.0 112.336 172.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.2 m120 54.85 50.58 15.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.243 1.417 . . . . 0.0 113.59 173.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -57.42 -20.69 31.73 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.151 0.98 . . . . 0.0 113.385 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -54.99 -28.83 54.97 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.229 1.412 . . . . 0.0 113.072 171.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -78.9 -16.45 57.01 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.222 1.009 . . . . 0.0 112.989 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -92.78 159.26 15.48 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.76 148.87 34.63 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.089 2.156 . . . . 0.0 110.202 171.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.0 mt -81.5 153.19 26.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.462 0.648 . . . . 0.0 109.586 167.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -150.56 150.28 31.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.495 . . . . 0.0 109.331 -170.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 . . . . . 0 N--CA 1.474 0.771 0 O-C-N 120.945 -1.097 . . . . 0.0 112.082 178.03 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.467 0.416 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.3 mm -80.08 131.03 35.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.652 0.739 . . . . 0.0 110.711 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 45.5 p -148.39 171.76 15.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.214 2.206 . . . . 0.0 109.321 -173.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.79 -21.54 60.96 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.905 -1.122 . . . . 0.0 113.288 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -84.02 -28.07 27.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.472 1.509 . . . . 0.0 113.564 173.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -109.53 -21.25 12.55 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -170.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.07 -25.15 65.16 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -173.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -62.66 -22.4 66.42 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.693 1.197 . . . . 0.0 113.298 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -74.48 -14.66 60.85 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.913 0.885 . . . . 0.0 113.033 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 69.7 mt -73.26 132.74 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.475 1.11 . . . . 0.0 109.876 174.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -125.8 169.78 12.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.28 1.832 . . . . 0.0 112.283 174.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -58.99 128.22 36.12 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.742 -0.599 . . . . 0.0 111.08 173.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.88 8.76 78.88 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.93 1.252 . . . . 0.0 115.417 -175.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.9 m -64.83 133.57 52.21 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 119.643 1.722 . . . . 0.0 111.179 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.3 mt -95.32 121.33 45.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.576 0.75 . . . . 0.0 109.194 170.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.5 mt -113.25 175.2 5.55 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.846 2.058 . . . . 0.0 110.555 177.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -139.07 148.7 43.68 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.295 1.838 . . . . 0.0 110.257 169.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.7 tp -89.68 139.53 30.47 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.47 1.108 . . . . 0.0 110.327 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.66 154.41 28.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.206 1.002 . . . . 0.0 110.823 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 29.1 p -73.16 136.7 44.82 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.768 -1.208 . . . . 0.0 110.76 169.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 CA--C 1.538 0.489 0 C-N-CA 125.057 1.343 . . . . 0.0 112.167 -174.842 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mt . . . . . 0 N--CA 1.471 0.593 0 CA-C-O 120.717 0.294 . . . . 0.0 111.452 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.61 131.59 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.622 1.569 . . . . 0.0 112.272 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -79.08 137.81 37.68 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.734 1.214 . . . . 0.0 110.886 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.43 160.17 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.89 1.676 . . . . 0.0 112.341 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.41 116.95 26.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.261 . . . . 0.0 110.356 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.2 mt -105.1 126.49 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.911 0.885 . . . . 0.0 111.007 -171.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -84.02 142.31 30.56 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.848 1.659 . . . . 0.0 112.849 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -155.27 142.58 13.81 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 125.918 1.687 . . . . 0.0 110.424 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.21 145.53 93.41 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.708 2.272 . . . . 0.0 114.008 -175.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.14 12.25 71.73 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.508 0.963 . . . . 0.0 115.508 177.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.5 158.08 43.93 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.279 1.431 . . . . 0.0 112.536 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -70.06 155.21 93.83 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 123.84 0.856 . . . . 0.0 111.52 169.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -59.48 130.0 33.66 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.814 2.342 . . . . 0.0 112.698 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -80.19 106.71 12.4 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.024 0.93 . . . . 0.0 109.982 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 60.4 mt -76.05 125.16 28.61 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.625 0.77 . . . . 0.0 109.401 169.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -153.95 178.26 10.12 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -114.91 125.75 54.0 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.154 0.982 . . . . 0.0 111.152 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.3 mt -88.43 108.58 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 170.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -80.87 114.21 19.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.095 0.558 . . . . 0.0 109.774 169.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -68.29 -11.24 59.11 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -76.81 -34.65 57.91 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.373 0.988 . . . . 0.0 112.802 169.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -76.97 145.13 73.36 Favored Pre-proline 0 N--CA 1.481 1.075 0 C-N-CA 125.283 1.433 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.86 142.87 64.54 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.046 2.497 . . . . 0.0 111.17 175.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -59.1 -32.94 70.27 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-O 118.545 -0.74 . . . . 0.0 112.29 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.41 -41.52 85.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.64 1.109 . . . . 0.0 112.563 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.97 72.69 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.072 0.549 . . . . 0.0 112.254 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.67 -46.73 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.195 0.598 . . . . 0.0 110.332 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.4 mt -60.42 -38.57 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 125.043 1.337 . . . . 0.0 110.935 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -57.05 -46.92 82.07 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.246 0.93 . . . . 0.0 111.565 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -67.22 -28.57 68.18 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.509 1.124 . . . . 0.0 113.324 177.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.79 -52.33 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.523 1.056 . . . . 0.0 110.023 169.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.5 m -61.8 -44.27 97.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.901 0.881 . . . . 0.0 111.793 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -59.11 -29.21 67.21 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.12 1.368 . . . . 0.0 112.905 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.07 -23.47 66.02 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.401 1.0 . . . . 0.0 114.469 173.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -117.33 13.7 14.59 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.032 1.733 . . . . 0.0 113.23 172.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t 55.52 28.53 11.89 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.115 1.766 . . . . 0.0 114.351 -176.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.5 mt -74.21 125.29 28.07 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.314 1.446 . . . . 0.0 111.458 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.68 163.61 27.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.53 1.132 . . . . 0.0 112.516 174.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 54.25 53.29 11.17 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.637 1.575 . . . . 0.0 113.89 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 -58.26 -18.11 24.22 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.171 0.988 . . . . 0.0 113.562 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -55.84 -28.84 58.34 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.986 1.315 . . . . 0.0 113.008 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -79.68 -15.84 56.83 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.03 0.932 . . . . 0.0 112.771 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -94.43 159.27 15.18 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.625 1.202 . . . . 0.0 114.11 -169.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.32 151.24 36.26 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.396 2.278 . . . . 0.0 110.105 173.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.0 mt -82.33 156.64 24.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 166.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -148.87 150.08 32.37 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.649 1.18 . . . . 0.0 110.496 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 . . . . . 0 N--CA 1.472 0.655 0 O-C-N 121.608 -0.682 . . . . 0.0 112.795 173.601 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 120.911 0.386 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 41.6 mm -81.51 134.21 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.228 1.011 . . . . 0.0 110.307 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -143.95 168.9 18.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.271 1.828 . . . . 0.0 109.661 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.21 -13.5 28.38 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.685 -1.259 . . . . 0.0 113.213 174.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -99.07 -6.75 27.86 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.633 1.973 . . . . 0.0 114.282 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.58 -15.97 4.39 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.094 1.358 . . . . 0.0 113.969 -173.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.95 -19.53 62.84 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -62.31 -22.51 66.11 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.843 1.257 . . . . 0.0 112.838 173.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -75.56 -13.45 60.35 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.108 0.963 . . . . 0.0 113.253 176.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.92 131.26 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.184 0.994 . . . . 0.0 109.603 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -124.61 169.85 11.52 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.912 1.685 . . . . 0.0 111.791 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -57.13 126.1 25.68 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 111.278 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.22 11.06 76.63 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.075 1.322 . . . . 0.0 115.445 -176.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.3 m -67.26 128.8 37.75 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.626 1.713 . . . . 0.0 111.405 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -83.36 126.23 40.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 169.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.7 mt -121.47 175.56 6.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.678 1.991 . . . . 0.0 110.867 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 73.8 ttt-85 -137.53 133.53 34.63 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 127.364 2.266 . . . . 0.0 110.033 176.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.5 tp -81.86 137.48 35.23 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 167.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.0 t -157.08 152.76 26.84 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.134 0.574 . . . . 0.0 111.239 -175.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.1 p -70.62 138.94 51.22 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.131 -0.981 . . . . 0.0 109.304 167.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.543 0.707 0 C-N-CA 126.022 1.729 . . . . 0.0 112.003 -178.834 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.9 mt . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 m -134.36 132.45 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.349 1.46 . . . . 0.0 111.489 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -77.16 144.09 38.62 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.53 155.19 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 125.922 1.689 . . . . 0.0 111.391 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.9 112.95 21.02 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.563 1.145 . . . . 0.0 110.331 175.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.2 mt -102.52 126.4 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.909 0.884 . . . . 0.0 111.075 -169.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -82.24 146.87 29.26 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.14 1.776 . . . . 0.0 113.215 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -154.25 141.39 13.45 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 125.854 1.662 . . . . 0.0 110.232 168.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.54 138.1 73.58 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.664 2.243 . . . . 0.0 113.463 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.07 12.77 72.15 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.309 0.883 . . . . 0.0 115.309 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.85 152.96 50.85 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.222 1.409 . . . . 0.0 112.641 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -68.99 150.67 97.54 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 123.898 0.879 . . . . 0.0 111.072 170.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.37 129.68 30.78 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.471 2.114 . . . . 0.0 113.179 -179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -80.57 110.75 16.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.608 1.163 . . . . 0.0 110.36 176.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.3 mt -77.33 126.54 31.09 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.487 0.715 . . . . 0.0 109.818 169.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.0 ptm -155.02 177.46 11.3 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.291 1.036 . . . . 0.0 111.555 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -112.74 136.07 52.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.962 0.905 . . . . 0.0 112.6 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.8 mt -96.78 109.49 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 125.563 1.545 . . . . 0.0 107.914 169.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -84.56 116.84 23.36 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -66.98 -11.78 57.86 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -86.62 -22.54 26.13 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.747 1.219 . . . . 0.0 113.63 170.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -82.12 142.82 48.14 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.324 1.05 . . . . 0.0 111.57 175.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.57 144.9 68.39 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.403 2.736 . . . . 0.0 111.621 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.5 mt -60.33 -32.67 71.46 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.084 176.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 m -58.85 -42.9 90.43 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.418 1.008 . . . . 0.0 112.583 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.56 -39.4 77.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.067 0.547 . . . . 0.0 111.981 174.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.46 -46.35 95.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.523 0.729 . . . . 0.0 110.687 176.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.8 mt -60.84 -38.24 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.93 1.292 . . . . 0.0 111.281 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.04 -38.7 89.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.4 0.68 . . . . 0.0 112.251 171.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.34 -24.74 62.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.235 1.014 . . . . 0.0 113.195 173.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.6 t -69.87 -58.04 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 119.604 1.093 . . . . 0.0 110.704 169.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 15.3 p -63.74 -33.52 75.83 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.502 0.721 . . . . 0.0 112.654 -169.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -61.43 -26.98 68.23 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.58 1.152 . . . . 0.0 113.045 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.36 -22.86 71.48 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.279 0.942 . . . . 0.0 114.225 174.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -119.03 11.81 12.56 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.985 1.714 . . . . 0.0 113.27 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 m 54.5 29.92 12.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.025 1.73 . . . . 0.0 114.376 -175.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.9 mt -77.6 127.03 31.8 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.542 1.137 . . . . 0.0 110.445 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.18 160.6 27.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.522 1.129 . . . . 0.0 113.445 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 51.55 69.11 0.7 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.774 2.03 . . . . 0.0 113.261 170.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -60.56 -18.83 55.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.546 1.138 . . . . 0.0 113.72 -176.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -54.75 -28.28 47.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.227 1.411 . . . . 0.0 112.933 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -78.29 -17.93 55.95 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.859 0.863 . . . . 0.0 113.204 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -99.21 158.58 15.59 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -168.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.79 149.83 33.09 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.597 1.959 . . . . 0.0 110.256 171.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.4 mt -76.56 154.67 34.28 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.445 0.64 . . . . 0.0 109.43 167.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -148.58 156.58 42.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.279 1.831 . . . . 0.0 108.808 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 . . . . . 0 N--CA 1.473 0.722 0 O-C-N 120.74 -1.225 . . . . 0.0 111.984 170.822 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 . . . . . 0 CA--C 1.537 0.472 0 CA-C-O 121.311 0.577 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.4 mm -80.71 134.35 27.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 123.942 0.897 . . . . 0.0 110.586 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -131.78 163.1 28.95 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.38 1.872 . . . . 0.0 111.029 -176.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -61.7 -16.24 47.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -86.04 -52.68 5.54 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.938 1.295 . . . . 0.0 112.693 169.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -86.67 -12.24 48.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -169.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.8 ptm180 -54.64 -23.42 17.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.972 1.309 . . . . 0.0 114.269 173.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -65.35 -18.61 65.45 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.11 1.364 . . . . 0.0 113.363 175.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -80.59 -12.68 59.48 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 113.533 173.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -71.0 134.26 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.902 0.881 . . . . 0.0 109.776 175.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -121.38 165.26 15.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.501 1.52 . . . . 0.0 112.219 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -60.53 123.16 16.55 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.001 0.52 . . . . 0.0 110.985 177.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.43 11.0 63.08 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.259 1.409 . . . . 0.0 115.476 -174.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.3 m -66.15 129.71 40.73 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.729 1.765 . . . . 0.0 110.973 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.2 mt -85.11 125.18 40.39 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.7 mt -119.06 -179.42 3.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.682 1.993 . . . . 0.0 110.714 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.5 ttp-105 -145.89 135.47 23.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 127.637 2.375 . . . . 0.0 110.09 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.5 tp -84.45 138.25 32.92 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.592 0.757 . . . . 0.0 109.827 169.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.2 t -160.15 155.55 25.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.996 0.918 . . . . 0.0 110.369 -177.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.0 p -70.33 148.82 48.02 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.743 -1.223 . . . . 0.0 111.183 170.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.5 p . . . . . 0 CA--C 1.546 0.822 0 C-N-CA 124.77 1.228 . . . . 0.0 113.916 -171.955 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.9 mt . . . . . 0 N--CA 1.472 0.665 0 CA-C-O 120.591 0.234 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.3 m -133.11 135.05 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.636 1.574 . . . . 0.0 111.928 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -76.11 142.52 41.66 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.078 0.951 . . . . 0.0 111.676 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.7 m -142.34 157.31 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.563 1.545 . . . . 0.0 111.889 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.06 123.09 43.62 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.869 1.268 . . . . 0.0 110.029 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -111.09 126.09 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.02 0.928 . . . . 0.0 110.836 -170.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -83.54 142.23 31.03 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.033 1.733 . . . . 0.0 112.733 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -155.06 142.72 14.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.89 1.676 . . . . 0.0 110.535 170.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.32 142.98 88.03 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.681 2.254 . . . . 0.0 113.78 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.05 13.83 70.23 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 177.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.0 157.45 45.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.198 1.399 . . . . 0.0 112.645 -176.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -69.05 152.46 96.77 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.826 0.85 . . . . 0.0 111.411 170.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -60.33 128.4 26.07 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.737 2.291 . . . . 0.0 112.36 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -81.25 111.22 17.46 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.939 0.895 . . . . 0.0 110.283 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -78.32 128.69 34.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.579 0.752 . . . . 0.0 109.592 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.1 ptm -154.99 178.59 10.02 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.706 0.802 . . . . 0.0 112.418 174.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 -112.08 129.74 56.12 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.791 1.237 . . . . 0.0 111.481 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.9 mt -97.76 111.76 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 125.259 1.424 . . . . 0.0 108.362 170.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -85.95 117.36 24.75 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.966 -0.754 . . . . 0.0 108.966 169.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -66.24 -14.76 62.45 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -80.78 -30.81 35.96 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.139 1.375 . . . . 0.0 113.664 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -73.55 143.22 82.0 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 124.188 0.995 . . . . 0.0 111.377 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.85 142.39 62.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.015 2.477 . . . . 0.0 111.108 177.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -59.36 -32.43 70.11 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.539 -0.744 . . . . 0.0 112.173 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m -58.51 -41.86 86.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.624 1.102 . . . . 0.0 112.76 176.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.78 -40.9 72.31 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.064 0.546 . . . . 0.0 112.127 175.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.61 -46.09 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.399 0.68 . . . . 0.0 110.533 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.36 -37.34 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.826 1.251 . . . . 0.0 110.969 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -61.26 -41.94 97.78 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.477 1.035 . . . . 0.0 112.243 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -66.84 -28.51 68.41 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.392 1.077 . . . . 0.0 112.959 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.0 -54.29 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.374 0.988 . . . . 0.0 110.177 168.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -61.22 -41.77 97.44 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.222 1.009 . . . . 0.0 112.137 -174.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.05 -29.85 68.8 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.142 0.977 . . . . 0.0 112.925 175.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.91 -23.35 65.59 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.348 0.975 . . . . 0.0 114.403 174.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -117.54 14.41 14.53 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.982 1.713 . . . . 0.0 113.177 172.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.67 28.58 12.28 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.099 1.76 . . . . 0.0 114.337 -177.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.6 mt -74.79 127.36 32.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.17 1.388 . . . . 0.0 111.622 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.63 165.51 24.18 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.689 1.196 . . . . 0.0 112.461 173.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 53.96 54.77 9.24 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.558 1.543 . . . . 0.0 113.629 173.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -58.31 -21.2 48.31 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.928 0.891 . . . . 0.0 112.987 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -56.61 -28.14 59.75 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.548 1.539 . . . . 0.0 112.827 175.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -80.63 -17.5 51.08 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.967 0.907 . . . . 0.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -90.77 159.9 16.07 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.539 1.162 . . . . 0.0 113.869 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.24 151.27 37.31 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.789 2.436 . . . . 0.0 109.828 172.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.7 mt -82.92 158.61 22.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 166.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -149.4 145.64 27.06 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 124.648 1.179 . . . . 0.0 110.494 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.0 m-70 . . . . . 0 N--CA 1.473 0.712 0 O-C-N 121.67 -0.644 . . . . 0.0 110.996 171.946 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 . . . . . 0 CA--C 1.541 0.603 0 CA-C-O 120.758 0.313 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mm -83.82 133.86 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.77 1.228 . . . . 0.0 110.549 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.3 p -144.55 165.73 27.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 127.005 2.122 . . . . 0.0 110.178 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.19 -11.91 17.13 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 121.041 -1.037 . . . . 0.0 113.344 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -90.46 -20.96 22.13 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.765 1.626 . . . . 0.0 114.585 176.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -135.51 -2.41 2.45 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -173.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.49 -22.16 12.08 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 175.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -62.59 -18.49 62.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.172 1.389 . . . . 0.0 113.415 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -73.38 -14.72 61.33 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.5 mt -72.87 128.82 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.92 0.888 . . . . 0.0 109.601 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -120.13 174.56 6.41 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.112 1.765 . . . . 0.0 112.246 172.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -57.52 130.46 46.42 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.907 -0.495 . . . . 0.0 111.24 170.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.56 10.93 83.77 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 124.71 1.148 . . . . 0.0 115.367 -177.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 90.3 m -65.67 129.65 40.5 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.618 1.709 . . . . 0.0 110.967 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 35.1 mt -86.28 122.07 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 170.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.3 mt -118.57 174.66 6.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.155 1.782 . . . . 0.0 111.082 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.2 ttt-85 -138.57 135.07 34.63 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 127.338 2.255 . . . . 0.0 109.851 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -83.24 136.66 34.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.048 0.539 . . . . 0.0 109.651 168.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.1 t -158.26 149.26 20.78 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.776 0.83 . . . . 0.0 110.82 -174.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.6 p -71.54 132.97 45.45 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.655 -1.278 . . . . 0.0 110.627 170.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 CA--C 1.539 0.548 0 C-N-CA 125.125 1.37 . . . . 0.0 112.196 -176.056 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.1 mt . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.7 m -133.2 131.71 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.23 1.412 . . . . 0.0 111.945 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -77.46 138.58 39.33 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.957 0.903 . . . . 0.0 111.168 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -137.47 157.07 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.7 1.6 . . . . 0.0 111.62 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.91 132.4 55.33 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.266 1.026 . . . . 0.0 109.886 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.0 mt -121.28 123.55 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.042 0.937 . . . . 0.0 110.628 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -82.46 143.85 30.86 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.151 1.381 . . . . 0.0 112.899 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -156.09 143.8 14.07 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.915 1.686 . . . . 0.0 110.161 169.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -62.77 144.98 94.71 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.665 2.243 . . . . 0.0 113.918 -175.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.0 11.48 74.46 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.82 155.66 44.21 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.192 1.397 . . . . 0.0 112.585 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -70.09 152.53 95.77 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 123.507 0.723 . . . . 0.0 110.955 169.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -59.21 130.76 37.59 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.45 2.1 . . . . 0.0 113.408 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -78.47 118.09 20.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.726 1.21 . . . . 0.0 110.488 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.1 131.48 35.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.292 0.637 . . . . 0.0 109.404 168.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.8 ptm -155.73 176.71 12.26 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.145 0.978 . . . . 0.0 111.644 172.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -115.31 129.82 56.72 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.149 0.98 . . . . 0.0 111.745 176.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.8 mt -95.44 112.36 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 125.8 1.64 . . . . 0.0 108.504 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -86.32 116.99 24.84 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.353 1.061 . . . . 0.0 109.966 171.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -68.2 -13.36 62.18 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -78.76 -31.03 46.02 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.338 0.972 . . . . 0.0 113.184 169.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -77.03 144.88 72.73 Favored Pre-proline 0 N--CA 1.48 1.034 0 C-N-CA 123.984 0.914 . . . . 0.0 112.042 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.2 143.26 70.43 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.124 2.55 . . . . 0.0 111.214 175.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.34 -30.28 69.43 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.117 -0.944 . . . . 0.0 112.672 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.1 t -57.97 -47.14 83.84 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.246 1.385 . . . . 0.0 112.097 173.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.62 -40.34 95.32 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.63 -0.669 . . . . 0.0 112.13 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 94.3 mt -67.1 -45.93 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.672 0.789 . . . . 0.0 110.815 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.8 mt -61.36 -35.82 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.646 1.179 . . . . 0.0 110.645 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 tttp -62.55 -41.16 98.72 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.12 0.873 . . . . 0.0 112.394 171.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -65.37 -30.44 71.27 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.234 1.014 . . . . 0.0 113.101 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.59 -54.52 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 119.375 0.989 . . . . 0.0 110.247 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.3 m -61.36 -42.47 98.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.444 1.098 . . . . 0.0 112.089 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -60.2 -29.53 68.78 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.11 0.964 . . . . 0.0 112.859 175.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.61 -23.37 64.97 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.49 1.043 . . . . 0.0 114.364 174.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.57 16.09 14.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.939 1.696 . . . . 0.0 113.14 172.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.9 p 56.19 21.21 5.06 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.241 2.217 . . . . 0.0 115.505 -176.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.35 126.86 30.94 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.428 1.491 . . . . 0.0 111.649 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.87 164.33 24.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.697 1.199 . . . . 0.0 112.388 173.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 52.98 62.01 2.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.74 1.616 . . . . 0.0 113.464 173.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -61.17 -19.19 61.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.807 0.843 . . . . 0.0 112.808 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -53.25 -30.14 36.57 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.005 1.722 . . . . 0.0 113.198 170.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -76.69 -14.84 59.92 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.142 0.977 . . . . 0.0 113.046 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -102.38 158.55 16.12 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.886 1.275 . . . . 0.0 114.247 -168.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.77 150.97 39.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.258 2.223 . . . . 0.0 109.852 169.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.93 154.58 26.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 166.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -145.11 143.71 30.53 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.516 1.126 . . . . 0.0 109.896 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.7 m-70 . . . . . 0 N--CA 1.473 0.724 0 O-C-N 121.659 -0.651 . . . . 0.0 111.699 174.01 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 121.103 0.477 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -80.99 137.53 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.1 0.96 . . . . 0.0 110.109 174.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 15.5 p -144.28 168.43 20.07 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.507 1.923 . . . . 0.0 109.447 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -63.78 -4.19 2.97 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 177.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -118.89 -15.61 9.34 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.389 1.476 . . . . 0.0 114.662 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -90.12 -22.71 21.64 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.86 1.209 . . . . 0.0 113.633 173.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -59.4 -19.82 50.16 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -173.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -63.64 -24.61 67.86 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.332 1.053 . . . . 0.0 113.056 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -74.83 -16.08 60.71 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.834 0.854 . . . . 0.0 113.097 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.6 mt -71.06 133.33 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.102 0.961 . . . . 0.0 109.841 173.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -129.7 171.37 12.72 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.364 1.865 . . . . 0.0 111.328 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -60.24 121.32 11.66 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.911 -0.493 . . . . 0.0 110.312 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.16 8.56 81.61 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.849 1.214 . . . . 0.0 115.459 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.3 m -63.38 130.72 45.64 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.893 1.847 . . . . 0.0 110.564 173.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mt -91.65 123.61 43.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 123.351 0.66 . . . . 0.0 109.425 173.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -114.96 174.27 6.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.556 1.942 . . . . 0.0 110.943 177.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -137.49 136.05 37.36 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 127.082 2.153 . . . . 0.0 109.745 173.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.0 tp -79.47 136.72 37.0 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.25 0.62 . . . . 0.0 110.009 169.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.6 t -155.07 147.53 24.07 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.564 0.746 . . . . 0.0 111.036 -176.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -71.23 130.62 41.89 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.879 -1.138 . . . . 0.0 110.532 171.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.7 p . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 125.231 1.412 . . . . 0.0 114.371 -168.407 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 mt . . . . . 0 N--CA 1.471 0.58 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -134.37 133.33 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.434 1.494 . . . . 0.0 111.883 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -75.05 142.15 43.78 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.121 0.969 . . . . 0.0 110.767 174.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m -141.55 156.77 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.807 1.643 . . . . 0.0 111.223 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.75 124.77 50.44 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.376 1.07 . . . . 0.0 110.269 171.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mt -112.46 123.76 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.334 1.054 . . . . 0.0 110.761 -170.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -79.55 144.34 34.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 112.817 174.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -154.65 143.29 14.65 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.777 1.631 . . . . 0.0 110.359 169.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -63.88 142.1 80.73 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.592 2.195 . . . . 0.0 113.6 -173.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.52 70.94 Favored Glycine 0 CA--C 1.539 1.533 0 N-CA-C 115.378 0.911 . . . . 0.0 115.378 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.16 154.91 46.1 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.259 1.424 . . . . 0.0 112.558 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -70.15 151.71 95.91 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 123.692 0.797 . . . . 0.0 111.177 169.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -59.43 130.64 36.6 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.502 2.135 . . . . 0.0 113.377 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -80.22 117.9 21.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.544 1.137 . . . . 0.0 110.637 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt -79.73 130.84 35.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 168.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.5 ptm -154.57 179.51 8.97 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.296 1.038 . . . . 0.0 111.226 171.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -122.25 125.74 46.7 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.137 0.975 . . . . 0.0 111.753 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.4 mt -89.78 116.74 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 C-N-CA 125.638 1.575 . . . . 0.0 108.932 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -89.9 113.25 24.83 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.088 1.355 . . . . 0.0 109.715 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -69.61 -11.7 61.05 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -88.97 -15.99 32.84 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.51 1.124 . . . . 0.0 113.79 170.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -79.06 149.04 72.73 Favored Pre-proline 0 N--CA 1.481 1.103 0 CA-C-N 119.831 1.196 . . . . 0.0 112.203 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.48 146.25 84.64 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.899 2.4 . . . . 0.0 110.984 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 mt -63.49 -27.94 69.62 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 118.529 -0.748 . . . . 0.0 112.264 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.5 t -59.0 -45.99 89.29 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.663 1.119 . . . . 0.0 112.423 171.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.48 99.25 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.584 -0.697 . . . . 0.0 112.078 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 53.3 mt -65.18 -49.02 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.595 0.758 . . . . 0.0 110.877 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.7 mt -61.74 -36.31 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.122 0.969 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.31 -43.62 92.63 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.114 0.87 . . . . 0.0 112.21 170.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -66.94 -27.53 67.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.362 1.065 . . . . 0.0 113.079 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 16.0 t -68.37 -57.48 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 CA-C-N 119.576 1.08 . . . . 0.0 110.358 169.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.6 m -60.98 -40.86 95.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.259 1.024 . . . . 0.0 112.522 -173.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -61.12 -27.66 68.54 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.45 -23.68 68.71 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.391 0.996 . . . . 0.0 114.413 174.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -116.27 16.03 15.85 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.802 1.641 . . . . 0.0 113.146 172.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 m 55.22 26.6 8.62 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.977 1.711 . . . . 0.0 114.557 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.2 mt -73.57 125.33 27.73 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.079 1.352 . . . . 0.0 111.164 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.6 155.7 37.55 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.404 1.081 . . . . 0.0 112.507 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 49.46 71.6 0.37 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.62 1.968 . . . . 0.0 113.144 173.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 -60.85 -16.99 47.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.472 1.109 . . . . 0.0 112.944 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -52.07 -29.36 21.07 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.155 1.782 . . . . 0.0 113.101 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -75.51 -15.24 60.42 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.12 160.74 14.6 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -167.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.68 150.21 38.37 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.995 2.118 . . . . 0.0 110.127 169.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.05 154.48 28.11 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 166.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -147.43 147.13 29.9 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.676 1.19 . . . . 0.0 110.456 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 . . . . . 0 N--CA 1.474 0.753 0 O-C-N 121.448 -0.783 . . . . 0.0 110.945 171.792 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 . . . . . 0 CA--C 1.537 0.477 0 N-CA-C 110.453 -0.202 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 40.2 mm -78.08 132.26 32.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.884 0.874 . . . . 0.0 110.443 176.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.5 p -139.4 164.94 28.53 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 111.232 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -63.75 -6.76 6.13 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.802 1.241 . . . . 0.0 113.608 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -107.31 -8.08 16.49 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.169 1.788 . . . . 0.0 114.021 176.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -134.02 -5.28 2.74 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -55.9 -23.81 33.68 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -62.05 -21.72 65.15 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.251 1.42 . . . . 0.0 113.272 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -74.63 -14.17 60.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.012 0.925 . . . . 0.0 112.999 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.2 mt -71.55 130.61 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.046 0.938 . . . . 0.0 109.428 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -123.08 168.89 11.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.093 1.757 . . . . 0.0 112.255 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -60.86 123.41 17.46 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.768 -0.583 . . . . 0.0 110.942 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.71 11.3 64.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.268 1.413 . . . . 0.0 115.557 -174.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.2 m -65.73 131.87 47.37 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.704 1.752 . . . . 0.0 111.058 176.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mt -87.27 121.65 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -118.28 178.79 4.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.597 1.959 . . . . 0.0 110.551 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -144.44 136.32 26.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 126.759 2.023 . . . . 0.0 109.936 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.7 tp -82.77 138.15 34.12 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.131 0.572 . . . . 0.0 109.885 169.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.3 t -154.77 151.3 28.52 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.996 0.918 . . . . 0.0 110.409 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.4 p -68.9 131.81 45.7 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.89 -1.131 . . . . 0.0 110.396 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.8 t . . . . . 0 CA--C 1.543 0.702 0 C-N-CA 126.808 2.043 . . . . 0.0 112.79 -176.423 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.7 mt . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.4 m -132.51 131.87 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.988 1.315 . . . . 0.0 111.646 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.22 143.6 47.07 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.738 0.815 . . . . 0.0 110.635 172.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m -139.65 150.67 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.983 1.713 . . . . 0.0 110.988 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.37 109.54 19.23 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.558 1.143 . . . . 0.0 109.751 173.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.8 mt -99.8 124.59 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 123.848 0.859 . . . . 0.0 109.988 -173.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -93.29 149.37 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.254 1.422 . . . . 0.0 112.612 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -153.18 142.89 15.04 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.957 1.703 . . . . 0.0 110.276 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -59.99 138.9 85.01 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.698 2.265 . . . . 0.0 113.77 -175.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.85 12.8 75.08 Favored Glycine 0 CA--C 1.539 1.584 0 N-CA-C 115.436 0.934 . . . . 0.0 115.436 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.41 156.84 47.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.195 1.398 . . . . 0.0 112.912 -177.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -72.38 155.55 91.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 124.368 1.067 . . . . 0.0 111.15 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -65.89 129.26 21.61 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.554 2.169 . . . . 0.0 112.06 -177.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -79.42 106.05 11.17 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.321 1.448 . . . . 0.0 109.853 174.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.6 mt -75.38 126.89 31.92 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.338 0.655 . . . . 0.0 109.453 169.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.0 ptm -153.13 177.76 10.47 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.213 1.005 . . . . 0.0 111.462 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -117.06 129.93 56.33 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.002 0.921 . . . . 0.0 112.023 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.0 mt -92.39 109.28 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.343 1.457 . . . . 0.0 108.462 170.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -83.98 119.56 25.06 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -66.65 -11.18 52.75 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -176.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -86.76 -23.56 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.011 1.324 . . . . 0.0 113.856 171.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -78.56 141.31 60.5 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.454 1.024 . . . . 0.0 111.372 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.71 144.28 59.27 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.278 2.652 . . . . 0.0 111.628 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.71 -31.01 71.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.377 -0.82 . . . . 0.0 112.762 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -59.18 -46.83 87.39 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.874 1.215 . . . . 0.0 111.98 174.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.6 -39.64 91.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.589 -0.694 . . . . 0.0 112.329 176.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.81 -48.67 85.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.491 0.716 . . . . 0.0 110.513 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -62.7 -37.1 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.71 1.204 . . . . 0.0 110.977 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.53 -39.72 84.86 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.545 0.738 . . . . 0.0 112.038 170.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -73.26 -24.73 60.49 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.711 1.204 . . . . 0.0 113.762 173.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 32.3 t -69.31 -61.23 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.644 1.111 . . . . 0.0 110.587 169.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.8 p -64.08 -34.32 77.77 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.797 0.839 . . . . 0.0 112.624 -170.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.71 -29.24 69.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.879 0.872 . . . . 0.0 112.906 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.79 -23.54 67.4 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.406 1.003 . . . . 0.0 114.171 174.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -115.0 11.53 16.51 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.71 . . . . 0.0 113.288 172.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.65 29.34 13.48 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.088 1.755 . . . . 0.0 114.282 -176.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.0 mt -79.1 131.23 36.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.22 1.408 . . . . 0.0 110.705 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.89 164.43 22.64 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.697 1.199 . . . . 0.0 113.623 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 53.14 68.87 0.77 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.403 1.881 . . . . 0.0 113.749 170.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -62.65 -21.01 65.37 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.229 -0.92 . . . . 0.0 113.068 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -54.78 -31.01 58.25 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.737 1.615 . . . . 0.0 113.117 171.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -77.12 -21.0 54.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.791 0.837 . . . . 0.0 112.68 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.71 158.96 15.28 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 122.731 1.253 . . . . 0.0 114.002 -169.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.9 154.07 39.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.058 2.543 . . . . 0.0 109.585 174.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 34.1 mt -86.4 154.05 21.47 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 167.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -144.92 145.76 31.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.354 1.061 . . . . 0.0 110.561 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 . . . . . 0 N--CA 1.471 0.616 0 O-C-N 122.014 -0.429 . . . . 0.0 111.755 174.48 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 120.813 0.34 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.6 mm -83.6 135.05 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.847 0.859 . . . . 0.0 110.52 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.6 p -145.52 168.0 21.65 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.815 2.046 . . . . 0.0 109.119 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -62.0 -16.72 53.65 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 121.123 -0.985 . . . . 0.0 113.171 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -88.33 -34.56 17.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.664 1.586 . . . . 0.0 113.529 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -92.84 -25.43 18.11 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -57.27 -25.17 58.78 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -171.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -67.87 -15.3 63.56 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.354 1.062 . . . . 0.0 113.51 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -78.87 -16.19 57.37 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.5 mt -67.08 139.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.743 1.217 . . . . 0.0 110.09 175.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -126.79 161.63 27.74 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.405 1.482 . . . . 0.0 111.703 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -61.66 119.61 9.01 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.894 -0.504 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.47 10.71 60.29 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 125.333 1.444 . . . . 0.0 115.625 -174.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.9 m -63.66 132.44 51.09 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.615 1.707 . . . . 0.0 111.709 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.3 mt -86.62 125.33 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.566 0.747 . . . . 0.0 109.388 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -122.29 172.37 8.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.329 1.852 . . . . 0.0 111.156 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtm105 -131.09 143.73 50.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.531 1.932 . . . . 0.0 110.584 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.36 136.63 34.28 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 166.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.0 t -157.24 151.95 25.54 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.728 0.811 . . . . 0.0 111.044 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.8 p -72.23 136.66 46.43 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.674 -1.266 . . . . 0.0 110.846 171.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 CA--C 1.542 0.654 0 C-N-CA 125.516 1.527 . . . . 0.0 113.164 -173.003 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.5 mt . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -130.9 133.51 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.114 1.366 . . . . 0.0 112.209 -178.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -71.29 141.71 50.5 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.187 0.995 . . . . 0.0 111.518 171.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -141.28 153.05 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.46 1.504 . . . . 0.0 111.838 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.68 116.52 28.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.945 1.298 . . . . 0.0 109.966 173.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.9 mt -107.41 120.75 59.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.162 0.985 . . . . 0.0 110.607 -170.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -81.16 149.08 29.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.217 1.407 . . . . 0.0 112.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -152.53 142.88 15.26 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.798 1.639 . . . . 0.0 109.97 169.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -62.14 136.47 60.7 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.512 2.141 . . . . 0.0 113.416 -172.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.09 12.53 71.92 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 115.214 0.845 . . . . 0.0 115.214 -179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.41 154.32 50.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.098 1.359 . . . . 0.0 112.892 -177.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -68.83 153.8 95.56 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 124.433 1.093 . . . . 0.0 111.633 172.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -66.07 125.6 14.39 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.62 2.213 . . . . 0.0 111.68 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -77.74 110.64 12.77 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 110.415 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -75.94 127.09 32.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.294 0.638 . . . . 0.0 109.86 169.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 21.9 ptm -151.72 -178.0 6.45 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.259 1.024 . . . . 0.0 111.837 173.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -120.5 132.6 55.27 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.421 1.088 . . . . 0.0 112.117 176.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.3 mt -96.72 111.87 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.416 1.486 . . . . 0.0 108.836 171.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.69 115.44 20.95 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -67.23 -10.77 53.97 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -90.16 -22.55 21.67 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.743 1.217 . . . . 0.0 113.866 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -87.37 145.56 37.89 Favored Pre-proline 0 N--CA 1.482 1.152 0 CA-C-N 119.667 1.122 . . . . 0.0 111.336 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.36 146.42 56.4 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.272 2.648 . . . . 0.0 112.74 -173.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.88 -31.6 71.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.343 0.657 . . . . 0.0 112.533 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.3 m -60.27 -42.2 94.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.24 0.927 . . . . 0.0 112.471 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.07 78.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.194 0.598 . . . . 0.0 111.914 175.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.52 -49.05 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.288 0.635 . . . . 0.0 110.751 174.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 56.4 mt -61.35 -37.54 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.04 0.936 . . . . 0.0 111.146 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -59.33 -45.98 89.86 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.031 0.832 . . . . 0.0 111.974 170.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -68.89 -26.11 64.94 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.831 1.252 . . . . 0.0 113.094 177.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 67.1 t -68.01 -60.83 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 119.185 0.902 . . . . 0.0 109.505 168.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.2 m -58.02 -36.54 72.86 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.34 1.456 . . . . 0.0 113.381 -170.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -59.18 -27.9 66.12 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.194 0.998 . . . . 0.0 113.526 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.01 -27.28 73.24 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.326 -0.859 . . . . 0.0 114.205 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -106.48 13.81 27.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.454 1.502 . . . . 0.0 112.756 173.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.2 m 55.56 27.46 10.42 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.128 1.771 . . . . 0.0 114.211 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.2 mt -75.9 114.31 14.38 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.64 1.176 . . . . 0.0 110.909 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.75 162.0 30.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.357 1.063 . . . . 0.0 112.049 173.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 54.37 55.69 7.8 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.403 1.481 . . . . 0.0 113.332 176.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -57.76 -17.74 17.41 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 113.368 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -56.37 -28.58 59.62 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.11 1.364 . . . . 0.0 112.966 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -78.32 -14.86 59.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.158 0.983 . . . . 0.0 112.73 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -94.42 157.75 15.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.56 1.144 . . . . 0.0 114.054 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.51 145.65 31.14 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.13 2.172 . . . . 0.0 109.715 176.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -79.95 145.32 32.67 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.532 0.682 . . . . 0.0 109.593 168.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -134.06 146.85 50.71 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.371 1.869 . . . . 0.0 108.83 -176.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 . . . . . 0 N--CA 1.468 0.472 0 O-C-N 121.466 -0.771 . . . . 0.0 112.578 176.018 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.469 0.506 0 CA-C-O 120.758 0.313 . . . . 0.0 110.421 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.7 mm -75.11 130.11 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 123.438 0.695 . . . . 0.0 110.333 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.0 p -140.22 164.12 30.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.888 1.675 . . . . 0.0 110.845 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -60.6 -15.3 26.64 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.218 -0.926 . . . . 0.0 113.056 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -89.26 -15.03 34.52 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.078 1.751 . . . . 0.0 114.671 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -135.41 -7.21 2.25 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -174.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -57.16 -21.22 31.28 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -61.22 -21.58 63.98 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.914 1.286 . . . . 0.0 113.173 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.18 -13.97 60.5 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.201 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 80.4 mt -71.32 131.94 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.334 1.054 . . . . 0.0 109.778 174.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -116.23 170.37 8.58 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 112.507 171.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -58.79 128.58 37.92 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.912 -0.493 . . . . 0.0 111.013 169.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.1 9.46 76.84 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 124.961 1.267 . . . . 0.0 115.251 -176.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.7 m -64.96 130.19 42.48 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.546 1.673 . . . . 0.0 111.326 177.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.6 124.48 40.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.436 0.694 . . . . 0.0 109.321 170.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -122.38 177.79 5.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.991 2.116 . . . . 0.0 110.28 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -144.53 136.73 26.26 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.75 2.02 . . . . 0.0 110.019 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.0 tp -82.32 137.44 34.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.341 0.656 . . . . 0.0 109.999 169.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.5 t -157.26 159.45 37.62 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.168 0.987 . . . . 0.0 110.555 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.2 p -72.08 144.69 48.6 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.72 -1.238 . . . . 0.0 110.548 169.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.544 0.724 0 C-N-CA 125.729 1.612 . . . . 0.0 113.029 -174.903 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.471 0.591 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -132.08 134.29 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.656 1.583 . . . . 0.0 111.413 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.1 143.03 35.93 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.02 0.928 . . . . 0.0 110.992 174.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.93 157.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.737 1.615 . . . . 0.0 111.459 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.21 115.91 26.85 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.637 1.175 . . . . 0.0 110.033 172.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.1 mt -104.65 125.16 59.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 123.833 0.853 . . . . 0.0 110.333 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -89.16 144.34 26.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.887 1.275 . . . . 0.0 112.316 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -153.79 143.99 15.59 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.104 1.762 . . . . 0.0 110.068 173.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -62.79 145.06 94.7 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.724 2.283 . . . . 0.0 113.985 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 11.34 75.08 Favored Glycine 0 CA--C 1.539 1.552 0 N-CA-C 115.484 0.954 . . . . 0.0 115.484 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.7 156.82 44.66 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.215 1.406 . . . . 0.0 112.64 -177.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -69.55 153.77 95.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 123.767 0.827 . . . . 0.0 111.314 169.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.74 128.98 28.76 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.516 2.144 . . . . 0.0 112.907 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -81.0 112.08 18.07 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.91 1.284 . . . . 0.0 110.365 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -76.64 127.5 32.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.455 0.702 . . . . 0.0 109.62 169.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -153.89 171.6 18.72 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.171 0.988 . . . . 0.0 111.538 177.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -114.85 124.54 52.0 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.796 0.838 . . . . 0.0 112.82 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.0 mt -91.6 110.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 125.705 1.602 . . . . 0.0 108.5 174.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -85.48 117.07 24.17 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.779 0.832 . . . . 0.0 109.259 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -67.23 -13.32 61.86 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -84.26 -23.14 30.51 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.613 1.165 . . . . 0.0 113.45 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -79.94 148.03 67.38 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 124.569 1.148 . . . . 0.0 111.926 177.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.58 141.25 49.78 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.748 2.299 . . . . 0.0 111.041 175.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.38 -31.63 70.53 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.002 0.521 . . . . 0.0 112.004 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -59.82 -42.64 93.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.211 0.914 . . . . 0.0 112.804 175.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.34 79.74 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.823 -0.548 . . . . 0.0 111.99 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.57 -48.18 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.669 0.787 . . . . 0.0 110.523 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -62.68 -35.76 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 124.075 0.95 . . . . 0.0 110.757 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -60.13 -44.09 95.18 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.401 1.001 . . . . 0.0 112.28 170.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -67.48 -34.02 76.31 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.421 1.088 . . . . 0.0 112.932 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.88 -53.17 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.917 0.887 . . . . 0.0 111.119 172.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 86.6 m -59.87 -42.57 94.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.819 0.848 . . . . 0.0 112.076 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.47 -27.89 68.89 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.641 0.776 . . . . 0.0 112.971 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.8 -23.64 65.67 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.457 1.027 . . . . 0.0 114.289 172.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -115.23 16.61 16.87 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.02 1.728 . . . . 0.0 113.161 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 56.29 25.14 9.0 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 126.049 1.739 . . . . 0.0 114.732 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.4 mt -75.13 122.89 24.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.236 1.414 . . . . 0.0 111.712 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 163.36 27.66 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.145 . . . . 0.0 112.168 171.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 53.06 52.95 12.77 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.454 1.501 . . . . 0.0 113.181 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -57.73 -24.76 58.53 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.146 0.979 . . . . 0.0 112.811 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -63.48 -12.71 33.96 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.321 1.448 . . . . 0.0 113.937 173.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -81.56 -17.45 48.36 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.309 -0.87 . . . . 0.0 112.739 168.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -94.98 160.96 14.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 122.637 1.208 . . . . 0.0 113.951 -169.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.66 152.51 42.51 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.721 2.409 . . . . 0.0 109.479 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.0 mt -82.81 155.59 24.11 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -143.4 144.03 31.88 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.442 1.097 . . . . 0.0 110.614 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 176.827 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.4 mm -82.65 132.52 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.625 0.77 . . . . 0.0 110.725 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.0 p -148.9 172.3 14.91 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.244 2.217 . . . . 0.0 109.275 -174.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.58 -20.74 57.89 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.802 -1.186 . . . . 0.0 113.325 172.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.22 -18.8 23.83 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.528 1.531 . . . . 0.0 113.72 175.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -114.87 -19.27 11.06 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -174.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -61.14 -23.12 65.3 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.528 1.306 . . . . 0.0 114.528 -175.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -63.94 -22.83 67.1 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.949 1.3 . . . . 0.0 113.184 173.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -75.26 -13.6 60.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 112.864 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.1 mt -74.14 128.66 36.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.4 1.08 . . . . 0.0 109.514 172.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -113.5 173.67 6.29 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.415 1.486 . . . . 0.0 111.946 169.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -61.69 130.88 47.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.692 -0.63 . . . . 0.0 111.14 170.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.14 9.98 83.28 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 125.143 1.354 . . . . 0.0 115.646 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 88.7 m -65.95 131.74 46.96 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 119.637 1.719 . . . . 0.0 111.736 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 51.1 mt -85.34 127.73 39.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 123.574 0.75 . . . . 0.0 109.351 169.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.4 mt -124.05 171.78 9.49 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.841 2.056 . . . . 0.0 110.855 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -133.38 136.2 45.16 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 127.077 2.151 . . . . 0.0 110.229 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -82.27 137.57 34.81 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 168.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.8 t -156.76 150.09 24.25 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.776 0.83 . . . . 0.0 111.44 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.6 p -70.54 127.51 32.96 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.748 -1.22 . . . . 0.0 110.287 170.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.2 t . . . . . 0 CA--C 1.537 0.46 0 C-N-CA 125.197 1.399 . . . . 0.0 112.703 -172.466 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.9 mt . . . . . 0 N--CA 1.469 0.521 0 CA-C-O 120.765 0.317 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.9 m -134.22 131.3 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.005 1.322 . . . . 0.0 112.609 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -67.52 141.5 56.87 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.167 0.987 . . . . 0.0 110.952 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.1 m -142.03 153.55 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.797 1.239 . . . . 0.0 112.062 175.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.06 120.55 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.921 1.288 . . . . 0.0 109.602 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.0 mt -107.92 122.21 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.645 0.778 . . . . 0.0 110.593 -171.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -84.9 149.67 25.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.981 1.712 . . . . 0.0 113.187 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -156.74 142.2 12.58 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.038 1.735 . . . . 0.0 110.27 169.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -60.59 137.45 73.65 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.642 2.228 . . . . 0.0 113.506 -176.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.87 12.56 74.94 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.28 154.13 51.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.252 1.421 . . . . 0.0 112.61 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.07 152.82 92.75 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.659 0.784 . . . . 0.0 111.435 169.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -61.43 131.73 37.53 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.581 2.188 . . . . 0.0 113.063 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -82.77 109.05 16.58 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.105 0.962 . . . . 0.0 110.023 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.6 mt -74.83 132.04 41.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.41 0.684 . . . . 0.0 110.081 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ptp -154.02 179.97 8.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.218 1.007 . . . . 0.0 111.964 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -123.41 125.38 44.85 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.729 1.211 . . . . 0.0 111.338 171.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.6 mt -86.79 110.96 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 124.629 1.172 . . . . 0.0 108.891 172.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -82.99 121.59 27.2 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.152 0.981 . . . . 0.0 108.462 167.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -69.8 -10.38 58.19 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -86.38 -15.18 41.22 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.473 1.286 . . . . 0.0 114.473 169.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -87.79 140.72 31.39 Favored Pre-proline 0 N--CA 1.479 0.994 0 CA-C-N 120.071 1.305 . . . . 0.0 111.142 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 144.09 62.51 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.315 2.676 . . . . 0.0 111.443 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 mt -59.68 -33.4 71.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.94 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.57 -43.75 89.53 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.26 0.936 . . . . 0.0 112.637 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.73 -38.94 77.03 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.95 0.5 . . . . 0.0 112.147 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.87 -47.27 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.476 0.71 . . . . 0.0 110.422 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.1 mt -62.52 -36.24 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.903 1.281 . . . . 0.0 111.144 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -61.86 -39.55 92.27 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.954 0.797 . . . . 0.0 112.385 170.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -70.01 -27.09 64.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.987 0.915 . . . . 0.0 113.278 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.7 t -69.39 -57.37 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.58 1.082 . . . . 0.0 110.82 169.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.5 p -63.96 -34.41 77.91 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.499 0.72 . . . . 0.0 112.557 -169.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.99 -27.61 68.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.31 1.044 . . . . 0.0 113.064 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.53 -22.98 70.12 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.305 0.955 . . . . 0.0 114.045 174.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -120.57 13.79 11.76 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.136 1.774 . . . . 0.0 113.106 176.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.4 m 55.77 29.22 13.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.249 1.82 . . . . 0.0 114.515 -178.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.91 128.2 33.17 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.659 1.183 . . . . 0.0 110.403 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.49 165.7 20.98 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.744 1.218 . . . . 0.0 113.35 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 53.87 63.1 2.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.121 1.769 . . . . 0.0 113.746 170.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -60.39 -19.98 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -177.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -57.32 -26.23 60.59 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.24 1.416 . . . . 0.0 113.193 171.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -81.37 -19.6 42.34 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.989 0.916 . . . . 0.0 112.782 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -92.09 157.88 16.51 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.583 1.182 . . . . 0.0 113.943 -169.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.32 154.38 41.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.014 2.526 . . . . 0.0 109.736 175.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.9 mt -89.69 151.19 21.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 167.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -142.05 147.0 36.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.636 1.174 . . . . 0.0 110.137 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 . . . . . 0 N--CA 1.472 0.67 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 177.853 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 120.673 0.273 . . . . 0.0 111.305 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 35.0 mm -80.3 132.81 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.37 1.068 . . . . 0.0 110.339 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 19.5 p -140.42 163.67 32.19 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.746 1.618 . . . . 0.0 111.023 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -61.27 -12.64 14.16 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.088 -1.008 . . . . 0.0 113.197 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -94.62 -15.24 24.18 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.156 1.782 . . . . 0.0 114.472 176.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -132.93 -7.73 3.09 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -176.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.95 -22.73 16.02 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -64.87 -18.26 65.01 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.569 1.548 . . . . 0.0 113.556 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -78.98 -14.54 59.15 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.097 0.959 . . . . 0.0 113.579 176.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.51 141.79 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 124.944 1.298 . . . . 0.0 110.101 174.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -127.4 160.87 30.1 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.212 1.405 . . . . 0.0 111.723 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -60.08 124.46 20.29 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.806 -0.559 . . . . 0.0 111.326 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.08 9.04 68.11 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.168 1.366 . . . . 0.0 115.174 -174.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 96.2 m -65.03 129.06 38.33 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.581 1.69 . . . . 0.0 111.105 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.0 mt -83.46 123.19 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 169.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -116.26 176.19 5.21 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.712 2.005 . . . . 0.0 110.161 174.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 33.5 ttp85 -143.94 135.94 26.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 126.367 1.867 . . . . 0.0 110.158 177.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 tp -77.64 140.53 39.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.844 0.858 . . . . 0.0 110.604 172.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.9 t -159.27 152.41 22.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.076 0.95 . . . . 0.0 111.425 -176.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 p -75.55 134.2 40.79 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.502 -1.374 . . . . 0.0 110.69 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 40.1 t . . . . . 0 CA--C 1.544 0.728 0 C-N-CA 125.336 1.454 . . . . 0.0 113.625 -172.884 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 N--CA 1.471 0.591 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.03 131.09 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.896 1.278 . . . . 0.0 112.03 -174.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -75.5 140.85 43.05 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.068 0.947 . . . . 0.0 110.568 172.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -140.79 155.56 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.54 1.536 . . . . 0.0 111.241 -178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.53 143.94 38.51 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.24 1.016 . . . . 0.0 109.638 168.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.9 mt -131.27 123.86 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.617 0.767 . . . . 0.0 110.481 -170.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -81.77 143.23 31.95 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.336 1.454 . . . . 0.0 112.703 174.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -155.61 142.55 13.56 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.75 1.62 . . . . 0.0 110.508 169.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -63.75 142.92 85.04 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.723 2.282 . . . . 0.0 113.63 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.18 13.45 70.19 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.346 0.898 . . . . 0.0 115.346 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.27 156.58 46.41 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.262 1.425 . . . . 0.0 112.587 -177.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -70.19 153.37 95.31 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.652 0.781 . . . . 0.0 111.267 169.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.11 128.13 25.45 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.663 2.242 . . . . 0.0 112.502 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -83.33 123.36 29.56 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.814 0.846 . . . . 0.0 110.696 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 83.3 mt -85.79 135.59 33.67 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.529 0.732 . . . . 0.0 109.549 168.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -156.49 174.83 14.86 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.57 1.148 . . . . 0.0 111.486 174.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -120.2 118.34 30.24 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.245 1.018 . . . . 0.0 111.605 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.6 mt -83.69 111.28 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.241 1.417 . . . . 0.0 108.929 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -85.37 118.32 24.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.423 1.089 . . . . 0.0 109.629 169.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -68.56 -12.52 61.4 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -84.18 -23.65 30.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.515 1.126 . . . . 0.0 113.43 171.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -76.13 147.26 79.75 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 123.946 0.898 . . . . 0.0 111.929 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.84 144.14 63.83 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.974 2.45 . . . . 0.0 111.1 171.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.42 -32.08 72.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.994 -0.527 . . . . 0.0 112.173 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.6 m -58.4 -42.39 87.03 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.07 0.85 . . . . 0.0 112.555 174.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -41.61 71.93 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.897 -0.502 . . . . 0.0 111.958 175.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.09 -47.96 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.492 -0.755 . . . . 0.0 110.678 176.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.2 mt -59.82 -40.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.491 1.116 . . . . 0.0 110.671 177.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -58.99 -42.84 91.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.149 0.886 . . . . 0.0 112.514 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.59 -32.27 72.89 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.474 0.71 . . . . 0.0 112.469 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -68.57 -51.94 41.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 O-C-N 121.509 -0.744 . . . . 0.0 110.942 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 95.3 m -58.98 -44.1 91.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.785 0.834 . . . . 0.0 112.092 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -60.77 -29.38 69.39 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.218 1.007 . . . . 0.0 112.93 176.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.5 -23.52 66.87 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.241 0.924 . . . . 0.0 114.411 174.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -112.96 14.24 19.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.863 1.665 . . . . 0.0 113.261 171.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.3 m 55.33 25.96 8.13 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.914 1.686 . . . . 0.0 114.438 -175.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.82 119.49 17.12 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.813 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.47 165.03 25.88 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.388 1.075 . . . . 0.0 112.193 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.3 m120 55.23 53.87 9.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.326 1.45 . . . . 0.0 113.417 173.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -57.8 -17.57 16.67 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.244 1.018 . . . . 0.0 113.654 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -56.42 -20.46 19.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.835 1.654 . . . . 0.0 113.859 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -84.85 -15.92 43.06 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.639 1.576 . . . . 0.0 112.497 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -99.2 159.9 14.65 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.55 151.03 37.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.849 2.459 . . . . 0.0 109.81 171.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.3 mt -84.21 155.44 22.51 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 167.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -149.81 150.03 31.39 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.673 1.189 . . . . 0.0 110.044 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 . . . . . 0 N--CA 1.473 0.686 0 O-C-N 121.582 -0.698 . . . . 0.0 112.671 174.583 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 CA--C 1.54 0.565 0 CA-C-O 120.61 0.243 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.9 mm -79.7 138.12 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.546 0.738 . . . . 0.0 110.715 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.4 p -146.3 173.37 12.31 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.492 2.317 . . . . 0.0 109.223 -175.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -58.47 -21.27 50.93 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 174.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -90.12 -45.65 8.99 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.775 1.23 . . . . 0.0 112.599 170.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -78.11 -21.16 50.82 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.994 0.918 . . . . 0.0 113.286 -171.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -57.81 -26.17 61.6 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.205 1.002 . . . . 0.0 113.676 173.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -74.0 -17.28 61.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.695 1.198 . . . . 0.0 113.071 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -79.4 -14.42 58.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.188 0.995 . . . . 0.0 112.831 173.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.3 mt -71.33 132.01 33.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.397 1.079 . . . . 0.0 109.641 174.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -122.88 165.24 16.99 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.903 1.681 . . . . 0.0 111.568 173.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -60.12 121.8 12.81 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 121.721 -0.612 . . . . 0.0 110.944 178.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.66 63.92 Favored Glycine 0 CA--C 1.541 1.663 0 C-N-CA 125.302 1.429 . . . . 0.0 115.648 -174.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.5 m -63.77 134.14 54.76 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.64 1.72 . . . . 0.0 111.191 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.6 mt -91.02 121.83 41.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 121.93 0.871 . . . . 0.0 109.3 169.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.2 mt -111.85 177.6 4.59 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.337 2.255 . . . . 0.0 110.434 176.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -139.24 145.89 39.78 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.144 1.778 . . . . 0.0 110.251 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.7 tp -85.11 140.16 31.17 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.718 0.807 . . . . 0.0 109.759 170.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -155.3 150.84 27.31 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.877 0.871 . . . . 0.0 111.061 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.3 p -76.13 134.33 40.0 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.796 -1.19 . . . . 0.0 110.435 169.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.4 t . . . . . 0 CA--C 1.544 0.716 0 C-N-CA 123.676 0.79 . . . . 0.0 112.122 -175.8 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.3 mt . . . . . 0 N--CA 1.47 0.563 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.4 m -133.36 133.28 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.929 1.292 . . . . 0.0 112.091 -176.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -78.85 140.32 38.19 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.931 0.892 . . . . 0.0 111.376 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.51 157.64 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 125.82 1.648 . . . . 0.0 111.638 -177.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.16 28.49 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.622 1.169 . . . . 0.0 110.201 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.3 mt -106.22 127.29 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 124.352 1.061 . . . . 0.0 110.442 -171.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 67.5 mt-10 -89.24 149.53 23.05 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.038 1.335 . . . . 0.0 112.994 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -151.63 142.86 15.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 126.093 1.757 . . . . 0.0 110.053 170.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -60.91 137.19 70.77 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.545 2.163 . . . . 0.0 113.54 -175.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.67 12.49 74.1 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.454 0.941 . . . . 0.0 115.454 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.9 153.4 51.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.201 1.4 . . . . 0.0 112.765 -178.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -69.64 151.41 96.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.653 0.781 . . . . 0.0 111.33 170.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.1 130.32 33.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 113.321 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.16 111.79 18.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.202 1.401 . . . . 0.0 110.234 175.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.8 127.87 33.11 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.404 0.682 . . . . 0.0 109.575 169.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -155.01 177.86 10.84 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.134 0.974 . . . . 0.0 111.602 173.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -113.34 135.07 54.26 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.933 . . . . 0.0 112.202 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.2 mt -95.57 110.01 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.721 1.608 . . . . 0.0 108.245 171.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -87.9 114.93 24.98 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.185 1.394 . . . . 0.0 110.074 175.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -70.9 -10.28 59.34 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -85.38 -21.93 28.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.372 1.069 . . . . 0.0 113.225 170.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -81.01 148.73 65.05 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 124.371 1.069 . . . . 0.0 112.781 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.05 146.39 76.87 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.94 2.427 . . . . 0.0 110.931 169.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -61.67 -29.85 70.35 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.556 177.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -58.7 -46.06 88.15 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.209 0.913 . . . . 0.0 112.232 172.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.14 -40.68 98.27 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.605 -0.684 . . . . 0.0 112.09 176.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 90.3 mt -66.42 -48.97 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.473 0.709 . . . . 0.0 110.568 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.78 -36.88 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.389 1.076 . . . . 0.0 110.94 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.69 -40.5 92.46 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.791 0.836 . . . . 0.0 112.304 171.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -70.74 -25.81 63.09 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.355 1.062 . . . . 0.0 113.589 173.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.83 -61.93 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.865 1.211 . . . . 0.0 110.902 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.9 p -63.51 -33.79 76.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.777 0.831 . . . . 0.0 112.76 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.02 -28.61 69.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.905 0.882 . . . . 0.0 113.017 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.94 -23.24 69.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.242 0.925 . . . . 0.0 114.205 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -115.79 12.99 16.04 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.864 1.666 . . . . 0.0 113.172 173.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m 55.78 27.04 10.23 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.0 1.72 . . . . 0.0 114.589 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.53 130.8 37.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.212 1.405 . . . . 0.0 110.738 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.65 163.84 21.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.598 1.159 . . . . 0.0 113.789 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 52.61 68.81 0.77 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.686 1.994 . . . . 0.0 113.65 169.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -63.58 -17.77 63.19 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 -171.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -54.65 -32.95 59.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.505 1.522 . . . . 0.0 112.989 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -73.09 -21.29 60.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.388 1.075 . . . . 0.0 112.692 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -94.53 158.3 15.6 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.587 1.184 . . . . 0.0 114.159 -169.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.28 150.04 34.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.679 2.391 . . . . 0.0 109.725 173.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.3 mt -81.86 158.58 23.97 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 166.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -148.93 148.12 29.44 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.573 1.149 . . . . 0.0 110.243 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 . . . . . 0 N--CA 1.471 0.609 0 O-C-N 121.933 -0.48 . . . . 0.0 111.69 172.022 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.1 mm -76.07 136.54 24.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.764 0.792 . . . . 0.0 110.108 174.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.4 p -142.86 171.42 14.08 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.251 2.22 . . . . 0.0 108.768 -175.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -59.95 -18.15 43.25 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.361 -0.837 . . . . 0.0 113.131 176.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -89.59 -54.07 4.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.907 1.683 . . . . 0.0 111.391 168.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -69.6 -23.59 63.55 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.12 0.968 . . . . 0.0 113.126 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -55.46 -27.95 51.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -73.21 -18.06 61.29 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.334 1.054 . . . . 0.0 112.972 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -85.44 -13.97 47.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.668 1.187 . . . . 0.0 112.648 176.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.8 mt -66.54 137.85 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.657 1.183 . . . . 0.0 109.648 172.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -137.43 165.76 25.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.406 1.882 . . . . 0.0 111.828 -179.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.39 124.54 18.44 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.852 -0.53 . . . . 0.0 112.015 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.61 10.24 73.6 Favored Glycine 0 CA--C 1.539 1.532 0 C-N-CA 124.843 1.211 . . . . 0.0 115.514 -175.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 91.9 m -63.57 128.7 37.01 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.761 1.781 . . . . 0.0 110.792 175.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -86.82 123.23 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.6 mt -119.07 174.09 6.52 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.18 1.792 . . . . 0.0 110.957 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -139.2 135.5 34.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.544 1.938 . . . . 0.0 109.996 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.3 tp -79.47 135.9 36.78 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.071 0.548 . . . . 0.0 109.664 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.6 t -155.65 154.48 31.66 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.158 0.983 . . . . 0.0 110.216 -175.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.7 p -71.96 134.48 45.99 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.411 -1.431 . . . . 0.0 110.386 169.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t . . . . . 0 CA--C 1.537 0.465 0 C-N-CA 124.298 1.039 . . . . 0.0 110.614 174.532 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 120.857 0.361 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.0 m -129.55 126.41 63.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.585 1.554 . . . . 0.0 111.597 -178.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -74.13 140.23 45.08 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.981 0.912 . . . . 0.0 110.84 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 m -137.91 154.45 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.13 1.372 . . . . 0.0 111.83 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.08 38.8 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.946 1.298 . . . . 0.0 109.615 171.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.4 mt -110.18 123.95 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.725 0.81 . . . . 0.0 110.38 -170.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -88.57 153.32 21.22 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.886 1.274 . . . . 0.0 113.238 176.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -153.76 142.48 14.47 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 126.134 1.773 . . . . 0.0 109.658 169.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -60.12 133.94 53.09 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.51 2.14 . . . . 0.0 113.295 -175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.93 11.04 78.37 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 115.409 0.924 . . . . 0.0 115.409 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.49 151.56 51.46 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.975 1.387 . . . . 0.0 112.805 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -70.34 150.27 95.83 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.703 0.801 . . . . 0.0 111.371 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -61.09 130.18 31.53 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.421 2.08 . . . . 0.0 113.383 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -83.55 111.15 18.82 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.121 1.368 . . . . 0.0 110.124 175.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.43 132.47 39.68 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.674 0.79 . . . . 0.0 110.227 169.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -157.24 178.08 10.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.411 1.085 . . . . 0.0 111.688 177.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -122.21 131.25 53.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.492 1.117 . . . . 0.0 112.174 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 mt -100.19 109.79 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.636 1.575 . . . . 0.0 108.864 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -81.14 117.85 22.04 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 168.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -65.05 -13.89 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -86.22 -22.21 27.03 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.758 1.223 . . . . 0.0 114.087 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -86.13 149.56 50.34 Favored Pre-proline 0 N--CA 1.483 1.181 0 CA-C-N 119.778 1.172 . . . . 0.0 111.691 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.47 144.01 39.74 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.067 2.512 . . . . 0.0 112.337 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.4 mt -61.77 -31.73 71.95 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.445 0.698 . . . . 0.0 112.438 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.4 m -59.38 -42.4 91.61 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.168 0.894 . . . . 0.0 112.301 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.5 81.83 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.145 0.578 . . . . 0.0 111.902 175.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.81 -50.76 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.492 0.717 . . . . 0.0 110.581 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.5 mt -61.51 -38.54 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.073 -1.017 . . . . 0.0 110.865 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.3 -38.95 88.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.721 0.809 . . . . 0.0 112.552 171.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -72.25 -27.81 62.74 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.396 1.079 . . . . 0.0 113.488 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.41 -61.11 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.259 -0.9 . . . . 0.0 111.098 172.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 30.2 p -61.55 -33.45 73.86 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.582 0.753 . . . . 0.0 112.849 -171.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -60.27 -30.85 69.72 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.325 1.05 . . . . 0.0 112.893 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -23.13 67.93 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.378 0.989 . . . . 0.0 114.064 175.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -114.9 12.36 16.85 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.955 1.702 . . . . 0.0 113.307 173.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.3 p 55.93 22.67 5.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 127.284 2.233 . . . . 0.0 115.4 -176.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.62 125.99 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.083 1.353 . . . . 0.0 110.677 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.0 166.2 22.6 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.636 1.174 . . . . 0.0 113.4 -177.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 m120 54.06 63.13 2.29 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.984 1.714 . . . . 0.0 113.397 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -59.85 -25.44 65.03 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.208 -0.933 . . . . 0.0 113.482 -174.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -64.73 -15.84 62.08 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.852 1.261 . . . . 0.0 113.89 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -77.81 -20.87 52.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.161 -0.962 . . . . 0.0 112.407 168.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -94.38 160.81 14.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.903 1.281 . . . . 0.0 114.145 -169.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.43 157.38 43.76 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.829 2.451 . . . . 0.0 109.917 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 40.3 mt -87.41 151.69 22.86 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 167.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -139.22 144.4 38.46 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.813 1.245 . . . . 0.0 109.959 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 . . . . . 0 N--CA 1.471 0.58 0 C-N-CA 123.061 0.544 . . . . 0.0 112.377 176.914 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 . . . . . 0 N--CA 1.469 0.494 0 CA-C-O 121.051 0.453 . . . . 0.0 110.645 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -77.92 134.06 29.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.507 0.723 . . . . 0.0 109.673 173.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -139.31 169.55 17.56 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.97 1.708 . . . . 0.0 109.776 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -58.41 -21.29 50.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.099 0.96 . . . . 0.0 113.385 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -93.59 -47.48 6.8 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.295 1.438 . . . . 0.0 112.667 169.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -76.64 -17.25 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -54.29 -25.45 23.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.967 1.307 . . . . 0.0 114.231 171.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -67.54 -15.87 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.072 0.949 . . . . 0.0 113.512 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -79.17 -11.63 59.97 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.077 0.951 . . . . 0.0 113.426 171.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.0 mt -71.53 134.47 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 O-C-N 121.272 -0.893 . . . . 0.0 109.771 173.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -121.5 166.36 14.27 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.843 2.057 . . . . 0.0 111.629 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -57.57 124.03 17.64 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 121.855 -0.528 . . . . 0.0 110.738 173.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.51 11.59 68.54 Favored Glycine 0 CA--C 1.539 1.549 0 C-N-CA 125.11 1.338 . . . . 0.0 115.465 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.4 m -65.12 131.62 47.02 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 119.455 1.628 . . . . 0.0 111.599 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.3 mt -85.31 124.4 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 169.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.6 mt -119.46 174.65 6.25 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.845 2.058 . . . . 0.0 110.263 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -141.92 137.46 31.32 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.938 1.695 . . . . 0.0 110.181 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -77.09 139.84 40.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.956 0.902 . . . . 0.0 110.595 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.2 t -157.35 151.38 24.6 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.976 0.911 . . . . 0.0 111.242 -176.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.0 p -69.86 126.71 30.51 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.565 -1.335 . . . . 0.0 110.321 169.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 45.0 t . . . . . 0 CA--C 1.536 0.424 0 C-N-CA 125.121 1.369 . . . . 0.0 111.875 -177.769 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.6 mt . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -135.48 132.82 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.056 1.342 . . . . 0.0 112.136 -177.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -71.34 141.14 50.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.98 0.912 . . . . 0.0 111.396 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.3 m -141.81 155.14 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.942 1.297 . . . . 0.0 111.927 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.16 39.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.898 1.279 . . . . 0.0 109.792 171.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -109.18 125.23 66.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.922 0.889 . . . . 0.0 110.48 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -91.89 151.05 20.73 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.879 1.272 . . . . 0.0 113.381 177.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -151.35 143.38 16.08 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.069 1.748 . . . . 0.0 109.937 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -59.67 135.16 62.25 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.544 2.162 . . . . 0.0 113.505 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.58 11.32 76.92 Favored Glycine 0 CA--C 1.539 1.571 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -132.81 152.37 51.82 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.873 1.336 . . . . 0.0 112.866 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -70.44 152.18 95.51 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 123.689 0.796 . . . . 0.0 111.515 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.34 129.72 29.37 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.5 2.133 . . . . 0.0 113.265 -178.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -82.56 109.31 16.65 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.205 1.402 . . . . 0.0 110.05 174.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.8 131.9 40.06 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.723 0.809 . . . . 0.0 110.205 170.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -156.48 178.19 10.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.198 0.999 . . . . 0.0 112.067 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -118.58 122.45 42.65 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.701 1.2 . . . . 0.0 111.474 174.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.3 mt -84.78 108.46 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 124.425 1.09 . . . . 0.0 108.257 169.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -81.77 114.86 20.7 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.094 0.957 . . . . 0.0 108.825 169.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.01 -12.07 60.1 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -175.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -88.44 -23.06 23.39 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.761 1.224 . . . . 0.0 113.422 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -78.94 143.07 61.1 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.182 0.993 . . . . 0.0 111.295 174.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.52 144.41 66.75 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.089 2.526 . . . . 0.0 111.411 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -61.69 -30.06 70.5 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 118.78 -0.629 . . . . 0.0 112.615 178.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.3 p -59.98 -44.68 94.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.644 1.111 . . . . 0.0 112.402 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.72 -40.02 88.25 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.263 0.625 . . . . 0.0 112.055 174.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.7 -46.89 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.585 0.754 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.05 -37.02 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.581 1.153 . . . . 0.0 111.077 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -61.49 -38.62 87.97 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.743 0.701 . . . . 0.0 112.32 171.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -72.03 -25.13 61.69 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.329 1.052 . . . . 0.0 113.337 174.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 46.4 t -72.07 -57.6 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.277 0.944 . . . . 0.0 110.976 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.7 p -62.18 -33.76 75.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.865 0.866 . . . . 0.0 112.562 -169.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.17 -28.94 69.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.557 1.143 . . . . 0.0 113.029 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.11 -23.0 69.41 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.303 0.954 . . . . 0.0 114.088 175.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -117.73 10.28 13.28 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.052 1.741 . . . . 0.0 113.193 174.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.0 t 54.69 33.6 19.77 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.274 1.83 . . . . 0.0 113.865 -176.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -80.69 125.21 29.75 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.708 1.203 . . . . 0.0 110.489 179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.26 165.82 22.81 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.77 1.228 . . . . 0.0 113.245 -178.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 54.03 59.83 4.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.922 1.689 . . . . 0.0 113.569 172.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -60.24 -19.97 56.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -176.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -56.27 -29.27 60.9 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.237 1.415 . . . . 0.0 112.913 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -78.9 -19.75 51.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.015 0.926 . . . . 0.0 112.726 178.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -91.16 158.32 16.69 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -169.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.73 150.67 35.82 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.354 2.262 . . . . 0.0 110.086 172.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -82.54 153.45 25.53 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 167.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -145.4 150.36 36.4 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.826 1.25 . . . . 0.0 109.698 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 . . . . . 0 N--CA 1.474 0.747 0 O-C-N 121.487 -0.758 . . . . 0.0 111.146 173.267 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 CA--C 1.536 0.412 0 CA-C-O 121.445 0.64 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.4 mm -82.19 129.6 37.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 124.375 1.07 . . . . 0.0 109.283 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.7 p -142.53 167.19 22.68 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.619 1.568 . . . . 0.0 109.965 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -63.1 -10.01 12.91 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 120.979 -1.076 . . . . 0.0 113.451 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -105.68 -4.88 20.49 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.517 1.927 . . . . 0.0 114.406 173.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -130.22 -14.48 3.83 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -174.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.55 -18.47 59.38 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 178.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.47 -22.58 66.97 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.869 1.268 . . . . 0.0 112.959 174.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -75.15 -14.17 60.53 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.987 0.915 . . . . 0.0 113.184 177.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -73.77 132.64 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.472 1.109 . . . . 0.0 110.172 177.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -118.13 167.31 11.6 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.144 1.778 . . . . 0.0 111.886 170.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -59.41 127.27 31.23 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.633 -0.667 . . . . 0.0 110.979 172.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.77 10.35 69.96 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.041 1.305 . . . . 0.0 115.305 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.5 m -65.98 131.39 46.13 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.563 1.682 . . . . 0.0 111.084 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mt -89.74 125.02 42.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 172.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 89.5 mt -120.37 173.45 7.13 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.679 1.992 . . . . 0.0 110.578 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -139.83 146.88 39.93 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.793 1.637 . . . . 0.0 110.594 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.7 tp -85.22 138.98 32.0 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.219 1.008 . . . . 0.0 110.173 173.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.7 t -157.65 156.37 31.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.157 0.983 . . . . 0.0 110.871 -176.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.4 p -71.02 139.26 50.43 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.415 -1.428 . . . . 0.0 110.568 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.9 p . . . . . 0 CA--C 1.543 0.675 0 C-N-CA 126.011 1.724 . . . . 0.0 113.635 -171.041 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.6 mt . . . . . 0 N--CA 1.471 0.621 0 CA-C-O 121.119 0.485 . . . . 0.0 111.416 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.5 m -133.67 135.36 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.033 1.733 . . . . 0.0 111.52 178.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.3 tttp -77.91 145.88 35.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.168 0.987 . . . . 0.0 110.873 172.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.9 m -141.73 155.5 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.777 1.631 . . . . 0.0 111.563 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.62 113.28 20.99 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.922 1.289 . . . . 0.0 109.992 174.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.7 mt -102.07 126.21 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.763 0.825 . . . . 0.0 110.839 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -82.9 143.1 30.96 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.722 1.609 . . . . 0.0 112.754 175.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -156.03 142.99 13.58 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.817 1.647 . . . . 0.0 110.429 170.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -63.24 143.9 90.55 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.699 2.266 . . . . 0.0 113.775 -174.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.84 71.42 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 115.476 0.95 . . . . 0.0 115.476 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -142.11 157.32 45.03 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.201 1.4 . . . . 0.0 112.641 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -70.21 154.1 94.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 123.762 0.825 . . . . 0.0 111.452 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.86 129.8 32.12 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.647 2.232 . . . . 0.0 112.746 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -81.15 109.63 15.88 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.095 0.958 . . . . 0.0 110.303 176.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.4 mt -76.91 126.16 30.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.48 0.712 . . . . 0.0 109.664 169.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.4 ptm -154.15 178.47 9.95 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.115 0.966 . . . . 0.0 111.766 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -115.96 137.72 51.85 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.401 1.081 . . . . 0.0 111.983 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.8 mt -105.33 114.03 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 C-N-CA 126.014 1.726 . . . . 0.0 108.717 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -87.53 119.93 28.33 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.887 0.875 . . . . 0.0 109.071 168.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -65.93 -15.07 62.64 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -83.95 -21.2 31.88 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.621 1.168 . . . . 0.0 113.977 172.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -80.2 146.97 63.81 Favored Pre-proline 0 N--CA 1.481 1.08 0 CA-C-N 119.386 0.994 . . . . 0.0 111.902 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.67 142.42 52.98 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.724 2.283 . . . . 0.0 111.06 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.5 mt -62.82 -29.61 70.86 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.298 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.6 p -60.83 -44.12 97.37 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.419 1.009 . . . . 0.0 112.576 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.87 87.63 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.574 0.625 . . . . 0.0 112.096 175.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.56 -48.38 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.345 0.658 . . . . 0.0 110.282 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -36.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.458 1.103 . . . . 0.0 111.213 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.68 -44.7 93.51 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.146 0.885 . . . . 0.0 112.066 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -66.51 -29.31 69.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.338 1.055 . . . . 0.0 113.074 174.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.92 -55.43 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.343 0.974 . . . . 0.0 110.514 169.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.07 -41.3 99.41 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.835 0.854 . . . . 0.0 112.182 -173.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.81 -27.29 68.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.634 0.774 . . . . 0.0 112.91 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.63 -23.58 67.15 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.425 1.012 . . . . 0.0 114.3 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -117.51 16.19 14.64 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.92 1.688 . . . . 0.0 113.144 172.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.1 m 55.59 26.42 9.14 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.92 1.688 . . . . 0.0 114.55 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.3 mt -72.46 125.41 27.35 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.113 1.365 . . . . 0.0 111.405 -178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.16 152.93 41.95 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.353 1.061 . . . . 0.0 112.352 176.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 49.27 68.11 0.78 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.458 1.903 . . . . 0.0 113.232 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -57.45 -17.25 12.29 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.971 1.308 . . . . 0.0 113.425 177.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -54.86 -27.93 46.21 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.705 1.602 . . . . 0.0 112.914 173.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -76.61 -18.37 58.65 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.938 0.895 . . . . 0.0 112.87 178.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -95.82 159.96 14.72 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -168.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.42 145.82 32.13 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.584 2.354 . . . . 0.0 109.563 172.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.46 154.96 28.53 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.456 0.646 . . . . 0.0 109.27 167.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -144.95 149.16 34.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 124.973 1.309 . . . . 0.0 110.019 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 . . . . . 0 N--CA 1.47 0.557 0 O-C-N 121.678 -0.639 . . . . 0.0 111.871 170.823 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.6 mm -74.59 135.45 27.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.169 0.588 . . . . 0.0 110.291 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 p -142.12 173.02 11.9 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.775 2.03 . . . . 0.0 109.436 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -57.82 -22.69 48.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -90.32 -48.94 6.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.824 1.25 . . . . 0.0 112.362 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -74.79 -20.13 59.92 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.162 0.985 . . . . 0.0 113.306 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -54.99 -26.53 37.5 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.423 1.089 . . . . 0.0 113.843 171.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -72.6 -15.92 61.73 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.317 1.047 . . . . 0.0 113.376 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.22 -13.04 60.02 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.162 0.985 . . . . 0.0 112.894 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.0 mt -70.52 129.99 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.98 0.912 . . . . 0.0 109.65 174.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -111.47 165.29 12.11 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.247 1.819 . . . . 0.0 111.867 170.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -61.29 125.5 23.97 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.604 -0.685 . . . . 0.0 110.929 174.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.67 13.71 69.44 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.039 1.304 . . . . 0.0 115.392 -174.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.0 m -64.55 131.0 45.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 119.763 1.782 . . . . 0.0 111.69 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.6 mt -80.68 121.32 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 168.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -113.91 177.96 4.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.333 1.853 . . . . 0.0 110.455 176.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -143.18 136.27 27.98 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 126.813 2.045 . . . . 0.0 110.285 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.4 tp -82.11 137.65 34.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.274 0.63 . . . . 0.0 109.734 169.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.1 t -155.87 154.63 31.57 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.121 0.968 . . . . 0.0 110.241 -177.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.5 p -70.03 141.0 52.94 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.547 -1.346 . . . . 0.0 110.571 170.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.2 t . . . . . 0 CA--C 1.542 0.656 0 C-N-CA 125.767 1.627 . . . . 0.0 113.164 -172.982 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 19.6 mt . . . . . 0 N--CA 1.47 0.572 0 CA-C-O 121.14 0.495 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.41 129.83 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 126.27 1.828 . . . . 0.0 110.867 175.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -73.61 143.32 46.41 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.956 0.902 . . . . 0.0 110.397 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.36 151.36 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.196 1.398 . . . . 0.0 111.171 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.09 129.01 56.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.526 1.13 . . . . 0.0 109.95 171.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -118.44 122.58 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.865 0.866 . . . . 0.0 110.821 -169.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -81.73 141.54 33.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.276 1.43 . . . . 0.0 112.86 175.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . 0.43 ' CD2' ' HD2' ' A' ' 15' ' ' PRO . 68.6 t-105 -158.84 139.53 9.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.677 1.991 . . . . 0.0 109.626 169.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.43 ' HD2' ' CD2' ' A' ' 14' ' ' TRP . 59.2 Cg_endo -68.08 150.59 77.49 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.131 2.554 . . . . 0.0 113.204 -173.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 73.46 9.96 78.55 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.188 0.899 . . . . 0.0 115.151 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.12 160.5 42.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.635 1.574 . . . . 0.0 112.248 -178.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -71.28 155.94 92.32 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.008 0.923 . . . . 0.0 111.743 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.36 126.95 22.24 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.871 2.381 . . . . 0.0 112.312 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -83.76 115.77 22.38 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.101 0.96 . . . . 0.0 110.973 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.48 130.93 35.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.247 0.619 . . . . 0.0 109.808 168.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -151.16 173.66 14.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.537 1.135 . . . . 0.0 110.998 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -126.79 114.23 17.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.21 1.004 . . . . 0.0 111.513 -173.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.7 mt -86.4 116.02 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 125.476 1.51 . . . . 0.0 109.744 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -82.51 117.84 22.81 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 167.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.0 -9.64 41.13 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -91.34 -19.89 22.44 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 170.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -87.16 148.58 45.32 Favored Pre-proline 0 N--CA 1.485 1.309 0 CA-C-N 120.225 1.375 . . . . 0.0 111.967 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.57 146.92 56.46 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.415 2.743 . . . . 0.0 112.577 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.84 -30.14 71.26 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 118.245 -0.883 . . . . 0.0 113.103 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.2 t -58.92 -45.23 90.83 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.991 1.269 . . . . 0.0 111.61 173.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.23 95.33 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.765 -0.584 . . . . 0.0 112.26 175.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 60.6 mt -60.9 -51.91 67.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.683 0.793 . . . . 0.0 111.251 175.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.4 mt -61.57 -39.83 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 123.943 0.897 . . . . 0.0 110.017 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -58.57 -43.61 89.45 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.758 0.708 . . . . 0.0 112.368 171.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -69.91 -26.33 64.11 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.565 1.146 . . . . 0.0 112.903 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.6 t -71.0 -61.39 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.919 0.888 . . . . 0.0 110.093 169.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -55.37 -39.2 69.82 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.56 1.544 . . . . 0.0 113.764 -173.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.87 -29.77 68.53 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.56 -29.79 72.94 Favored Glycine 0 CA--C 1.534 1.257 0 O-C-N 121.291 -0.881 . . . . 0.0 113.897 177.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -99.22 14.03 30.91 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.192 1.397 . . . . 0.0 112.883 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p 57.67 20.68 6.56 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.467 2.307 . . . . 0.0 115.322 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -72.39 113.42 9.42 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.877 1.271 . . . . 0.0 110.889 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.18 162.99 28.39 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.308 1.043 . . . . 0.0 112.207 174.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.5 m120 54.16 65.26 1.56 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.724 1.609 . . . . 0.0 112.777 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 32.3 p-80 -62.77 -14.34 43.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.353 1.061 . . . . 0.0 113.333 -177.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -54.57 -29.48 51.38 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.274 1.83 . . . . 0.0 113.407 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -74.98 -21.22 59.28 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.545 1.138 . . . . 0.0 112.86 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -98.24 160.01 14.57 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -168.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.24 156.42 39.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.305 2.242 . . . . 0.0 110.137 169.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.7 mt -80.32 154.53 27.73 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 167.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -142.17 144.8 33.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.655 1.182 . . . . 0.0 110.372 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 178.134 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 . . . . . 0 CA--C 1.537 0.446 0 CA-C-O 121.0 0.429 . . . . 0.0 109.958 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mm -80.14 135.65 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.849 0.859 . . . . 0.0 110.409 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -143.78 168.93 18.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.15 2.18 . . . . 0.0 108.86 -177.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -61.3 -15.55 36.63 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.367 -0.833 . . . . 0.0 113.229 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -87.99 -50.4 6.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.321 1.448 . . . . 0.0 112.082 168.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -77.22 -19.63 56.41 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.992 1.317 . . . . 0.0 114.375 -168.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -58.32 -17.91 23.39 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -66.23 -19.21 65.76 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 173.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -75.43 -16.14 60.37 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.134 0.974 . . . . 0.0 113.113 173.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.9 mt -75.67 128.65 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 123.967 0.907 . . . . 0.0 109.688 177.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -120.6 168.38 11.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.255 1.822 . . . . 0.0 111.842 171.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -61.16 121.96 13.84 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.613 -0.679 . . . . 0.0 111.312 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.23 10.19 62.61 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.438 1.494 . . . . 0.0 115.594 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.0 m -64.81 131.33 46.5 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 119.692 1.746 . . . . 0.0 111.861 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 43.7 mt -87.2 125.9 40.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.85 0.86 . . . . 0.0 109.784 169.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.1 mt -124.79 176.75 6.39 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.877 2.471 . . . . 0.0 109.924 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt85 -136.61 149.07 47.81 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.846 1.259 . . . . 0.0 110.814 168.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.2 tp -82.98 138.81 33.63 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.52 156.53 32.19 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.165 0.986 . . . . 0.0 110.67 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 26.8 p -70.63 132.44 45.45 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.62 -1.3 . . . . 0.0 110.418 169.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 p . . . . . 0 CA--C 1.545 0.764 0 C-N-CA 125.339 1.456 . . . . 0.0 112.498 -176.753 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.0 mt . . . . . 0 N--CA 1.469 0.51 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 10.3 m -129.79 127.47 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.19 1.396 . . . . 0.0 111.594 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -75.83 141.56 42.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.006 0.922 . . . . 0.0 111.03 175.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -140.68 156.83 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.498 1.519 . . . . 0.0 111.936 -176.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.28 116.24 26.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.789 1.235 . . . . 0.0 109.945 170.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.71 126.1 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 124.303 1.041 . . . . 0.0 110.568 -171.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -84.56 146.92 27.29 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.262 1.425 . . . . 0.0 113.147 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -153.34 142.18 14.43 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 125.941 1.696 . . . . 0.0 110.167 169.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -62.07 138.67 74.33 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.66 2.24 . . . . 0.0 113.592 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.73 13.21 71.58 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.355 0.902 . . . . 0.0 115.355 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.8 154.22 50.6 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.263 1.425 . . . . 0.0 112.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -68.56 148.35 98.1 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 123.522 0.729 . . . . 0.0 111.059 170.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.34 129.91 33.5 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.548 2.165 . . . . 0.0 113.064 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -81.08 111.62 17.7 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.64 1.176 . . . . 0.0 110.347 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -77.03 127.51 32.81 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.328 0.651 . . . . 0.0 109.651 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -154.86 178.18 10.45 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.014 0.925 . . . . 0.0 111.833 173.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -115.8 136.44 53.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.453 1.101 . . . . 0.0 111.924 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.0 mt -105.1 107.43 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 125.794 1.637 . . . . 0.0 108.225 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -78.34 117.04 19.2 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 168.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -67.07 -13.39 61.88 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -87.36 -21.96 25.35 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.188 0.995 . . . . 0.0 113.681 173.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -75.99 148.35 81.49 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 124.469 1.108 . . . . 0.0 111.852 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.02 139.34 42.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.978 2.452 . . . . 0.0 111.04 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.4 mt -61.44 -31.13 71.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.35 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.7 t -60.02 -44.51 94.56 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.56 1.073 . . . . 0.0 112.291 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -39.84 93.5 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.659 -0.651 . . . . 0.0 112.026 175.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.5 mt -65.03 -46.49 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.166 0.586 . . . . 0.0 110.619 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.1 mt -60.26 -38.2 76.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.658 1.183 . . . . 0.0 111.138 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -61.69 -40.15 93.97 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.4 0.68 . . . . 0.0 112.316 172.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -69.31 -25.66 64.34 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.396 1.078 . . . . 0.0 113.167 173.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.35 -58.99 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.438 1.017 . . . . 0.0 110.564 169.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.3 p -65.08 -35.05 79.92 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.238 0.615 . . . . 0.0 112.348 -169.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.53 -29.0 68.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.055 0.942 . . . . 0.0 112.922 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -22.98 68.47 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.421 1.01 . . . . 0.0 114.263 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -115.48 10.71 15.78 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.022 1.729 . . . . 0.0 113.053 172.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.1 t 54.96 31.1 15.29 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.049 1.74 . . . . 0.0 114.169 -175.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.41 125.42 29.51 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.707 1.203 . . . . 0.0 109.908 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.83 159.23 30.24 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 113.586 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 51.6 75.78 0.19 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.081 2.153 . . . . 0.0 113.325 170.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -62.33 -17.82 59.81 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.485 1.114 . . . . 0.0 113.661 -173.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -55.31 -30.88 61.07 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.224 1.41 . . . . 0.0 112.68 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -73.55 -23.49 59.98 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.155 0.582 . . . . 0.0 112.22 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -94.85 158.03 15.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.801 1.24 . . . . 0.0 114.331 -169.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.71 148.41 35.66 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.731 2.013 . . . . 0.0 109.748 169.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.29 148.33 35.76 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 167.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -141.39 153.99 45.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.344 1.458 . . . . 0.0 109.375 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 . . . . . 0 CA--C 1.535 0.401 0 O-C-N 121.314 -0.866 . . . . 0.0 112.427 171.77 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 N--CA 1.471 0.594 0 CA-C-O 121.027 0.441 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.82 131.15 34.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.096 0.958 . . . . 0.0 110.238 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -146.9 169.48 19.07 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.155 1.782 . . . . 0.0 110.102 -176.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -60.03 -18.0 43.03 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.734 -1.229 . . . . 0.0 113.458 172.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -96.0 -8.06 34.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.988 1.715 . . . . 0.0 114.296 175.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -133.69 -13.28 2.58 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 -172.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -59.95 -23.31 63.46 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 120.581 -1.324 . . . . 0.0 114.105 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -61.78 -22.69 65.65 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.394 1.478 . . . . 0.0 113.279 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -73.75 -19.55 60.75 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.641 0.777 . . . . 0.0 112.863 177.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 51.3 mt -68.76 132.71 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.97 0.908 . . . . 0.0 109.603 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -135.48 165.51 25.34 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.651 1.98 . . . . 0.0 111.882 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -57.62 116.04 3.15 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.332 0.653 . . . . 0.0 111.362 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.15 11.58 56.03 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.59 1.567 . . . . 0.0 115.568 -176.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.9 m -65.85 133.12 50.28 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.606 1.703 . . . . 0.0 111.781 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -85.19 121.97 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 170.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -118.7 -179.89 3.94 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.734 2.013 . . . . 0.0 110.873 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -148.55 137.45 21.6 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 127.331 2.252 . . . . 0.0 110.256 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 tp -85.27 137.88 32.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.754 0.821 . . . . 0.0 109.993 169.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.2 t -157.19 151.86 25.5 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.812 0.845 . . . . 0.0 110.917 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.3 p -71.03 132.63 45.43 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.988 -1.07 . . . . 0.0 110.298 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.9 p . . . . . 0 CA--C 1.541 0.616 0 C-N-CA 125.462 1.505 . . . . 0.0 114.199 -169.292 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.5 mt . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 m -129.44 132.17 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.937 1.295 . . . . 0.0 112.01 -177.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -69.15 146.42 52.49 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.761 0.824 . . . . 0.0 110.756 170.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m -143.69 151.58 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.408 1.483 . . . . 0.0 111.521 176.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.87 116.75 28.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.665 1.186 . . . . 0.0 109.854 173.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.7 mt -106.7 123.96 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.907 0.883 . . . . 0.0 110.823 -169.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -82.7 144.69 30.06 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.236 1.414 . . . . 0.0 112.933 174.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -154.83 143.44 14.67 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 126.003 1.721 . . . . 0.0 110.079 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -63.02 143.21 90.46 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.605 2.203 . . . . 0.0 113.789 -173.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.5 12.27 73.2 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 178.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.91 155.79 45.5 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.181 1.392 . . . . 0.0 112.702 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -69.47 152.86 96.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 123.803 0.841 . . . . 0.0 111.371 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.99 128.9 29.52 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.596 2.198 . . . . 0.0 113.17 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -78.29 111.32 14.14 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.623 1.169 . . . . 0.0 110.148 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.3 127.67 32.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.316 0.646 . . . . 0.0 109.584 169.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.4 ptm -152.63 -178.52 6.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.035 0.934 . . . . 0.0 111.67 172.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -122.44 129.64 52.26 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.49 1.116 . . . . 0.0 111.572 178.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.2 mt -96.26 112.87 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 C-N-CA 125.311 1.444 . . . . 0.0 108.664 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.99 120.47 26.15 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 167.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -64.92 -11.09 34.28 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -87.22 -21.9 25.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.944 1.298 . . . . 0.0 114.345 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -77.97 141.87 63.88 Favored Pre-proline 0 N--CA 1.483 1.191 0 CA-C-N 119.831 1.196 . . . . 0.0 111.513 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.19 144.22 56.32 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.333 2.688 . . . . 0.0 111.543 177.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.1 mt -63.72 -29.97 71.13 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.071 -0.966 . . . . 0.0 113.097 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.0 t -61.13 -44.82 96.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.397 1.453 . . . . 0.0 111.898 174.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.11 95.52 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.567 -0.708 . . . . 0.0 112.194 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.12 -50.41 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.399 0.679 . . . . 0.0 110.502 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.01 -35.66 69.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.299 1.04 . . . . 0.0 110.946 -179.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.02 -43.33 95.34 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.041 0.837 . . . . 0.0 112.081 170.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -68.74 -29.69 68.16 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.732 1.213 . . . . 0.0 113.121 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.16 -53.66 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 121.292 -0.88 . . . . 0.0 110.155 169.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.0 m -61.4 -43.73 98.37 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.161 0.984 . . . . 0.0 111.986 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -60.34 -29.72 69.07 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.098 0.959 . . . . 0.0 112.847 175.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.32 -23.58 62.45 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.395 0.998 . . . . 0.0 114.436 173.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.71 16.86 14.45 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.97 1.708 . . . . 0.0 113.25 171.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.0 p 56.33 21.02 5.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.281 2.232 . . . . 0.0 115.536 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -68.41 123.92 22.1 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.447 1.499 . . . . 0.0 111.423 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.89 158.73 31.72 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.445 1.098 . . . . 0.0 112.365 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 50.52 68.41 0.77 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.491 1.916 . . . . 0.0 112.998 173.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -62.2 -15.72 48.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.558 1.143 . . . . 0.0 113.158 -177.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -55.99 -26.92 50.59 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.754 1.622 . . . . 0.0 113.197 176.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -77.77 -15.9 58.77 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -98.18 157.65 16.03 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -168.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.65 149.24 35.35 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 127.297 2.239 . . . . 0.0 109.53 169.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -78.39 157.16 29.14 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -145.85 147.82 32.22 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.792 1.237 . . . . 0.0 110.157 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 . . . . . 0 N--CA 1.475 0.786 0 O-C-N 121.629 -0.669 . . . . 0.0 110.906 173.37 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.103 0.478 . . . . 0.0 110.005 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.1 mm -80.6 136.64 22.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.115 0.966 . . . . 0.0 110.083 175.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.0 p -144.43 169.51 17.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.236 2.214 . . . . 0.0 108.553 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -62.19 -11.78 16.41 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 177.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.76 -44.97 6.85 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.352 1.461 . . . . 0.0 112.509 168.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -76.25 -21.64 56.11 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.486 1.114 . . . . 0.0 113.509 -172.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -57.15 -22.23 38.63 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 176.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -66.86 -18.51 65.41 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.401 1.081 . . . . 0.0 113.377 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -79.83 -11.26 59.83 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.288 1.035 . . . . 0.0 113.452 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.4 mt -76.14 133.03 31.99 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.311 1.044 . . . . 0.0 109.651 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.75 166.89 15.39 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.724 2.01 . . . . 0.0 111.804 173.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -60.65 118.89 7.13 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.823 -0.548 . . . . 0.0 111.41 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.16 14.34 56.17 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 125.293 1.425 . . . . 0.0 115.436 -175.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -65.33 130.62 43.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.77 1.785 . . . . 0.0 111.28 177.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mt -84.29 121.92 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 170.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -117.88 174.62 6.08 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.255 1.822 . . . . 0.0 110.671 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -141.92 133.84 27.33 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 126.239 1.816 . . . . 0.0 109.976 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 tp -79.47 136.8 37.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.194 0.598 . . . . 0.0 110.138 170.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.3 t -157.53 151.0 23.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.421 1.088 . . . . 0.0 110.11 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.9 p -72.0 138.57 48.06 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.493 -1.38 . . . . 0.0 110.388 169.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p . . . . . 0 CA--C 1.544 0.712 0 C-N-CA 123.954 0.902 . . . . 0.0 112.234 -175.56 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.1 mt . . . . . 0 N--CA 1.47 0.57 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 m -129.02 123.3 58.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.484 1.114 . . . . 0.0 112.745 -173.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -72.86 137.72 45.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.37 1.468 . . . . 0.0 111.261 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.7 m -139.34 157.01 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.511 1.524 . . . . 0.0 111.956 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.54 118.47 32.73 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.817 1.247 . . . . 0.0 109.837 171.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.5 mt -106.03 123.97 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.805 0.842 . . . . 0.0 110.882 -171.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -85.53 143.57 28.43 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.062 1.745 . . . . 0.0 113.025 176.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -156.46 142.09 12.7 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.086 1.754 . . . . 0.0 110.1 169.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -59.12 145.88 96.25 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.999 2.466 . . . . 0.0 114.493 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.1 11.46 74.89 Favored Glycine 0 CA--C 1.539 1.56 0 N-CA-C 115.607 1.003 . . . . 0.0 115.607 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -144.72 158.6 43.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.104 1.361 . . . . 0.0 112.695 -177.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -70.65 155.42 93.42 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.012 0.925 . . . . 0.0 111.662 170.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -60.65 130.18 32.31 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.653 2.235 . . . . 0.0 112.732 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -82.74 108.74 16.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.354 1.061 . . . . 0.0 110.453 176.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.7 mt -76.4 128.03 34.03 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 110.17 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -155.3 175.37 13.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.411 1.084 . . . . 0.0 111.638 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -122.71 118.32 27.81 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.383 1.073 . . . . 0.0 111.584 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.8 mt -83.79 110.54 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 125.227 1.411 . . . . 0.0 108.848 175.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -81.95 116.48 21.6 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 169.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.68 -12.71 55.92 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.0 -26.63 26.97 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.35 0.977 . . . . 0.0 113.489 171.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -77.45 142.48 67.06 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.02 0.928 . . . . 0.0 111.396 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.22 143.15 63.48 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.12 2.547 . . . . 0.0 111.296 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.2 mt -60.69 -31.39 70.64 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.442 178.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.8 p -59.18 -45.4 91.12 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.597 1.09 . . . . 0.0 112.45 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.77 89.48 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.178 0.591 . . . . 0.0 112.109 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.73 -47.54 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.647 0.779 . . . . 0.0 110.843 177.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.52 -37.73 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.589 1.156 . . . . 0.0 110.761 178.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -62.93 -38.47 91.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 172.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -71.02 -23.94 62.27 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.262 1.025 . . . . 0.0 113.074 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 73.2 t -73.14 -62.32 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 O-C-N 121.107 -0.996 . . . . 0.0 111.005 169.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.8 p -59.74 -30.98 69.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.94 1.296 . . . . 0.0 113.652 -169.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.85 -28.38 67.47 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.573 1.149 . . . . 0.0 113.346 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.68 -26.08 74.83 Favored Glycine 0 CA--C 1.534 1.232 0 O-C-N 121.332 -0.855 . . . . 0.0 114.011 177.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.0 m0 -107.67 11.09 28.77 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.668 1.587 . . . . 0.0 112.84 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.8 m 55.41 29.23 12.77 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.157 1.783 . . . . 0.0 114.065 -176.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -80.51 121.01 25.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.602 1.161 . . . . 0.0 110.332 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.7 165.85 23.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.78 1.232 . . . . 0.0 113.214 -178.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 54.15 63.75 2.07 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.037 1.735 . . . . 0.0 113.417 173.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -59.77 -21.8 61.26 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.958 0.903 . . . . 0.0 113.35 -176.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -55.95 -28.92 59.14 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.211 1.405 . . . . 0.0 113.127 172.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -77.77 -16.81 58.12 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.785 0.834 . . . . 0.0 112.624 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -96.99 159.64 14.79 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -169.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.27 156.35 43.31 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.152 2.581 . . . . 0.0 109.78 171.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.0 mt -89.5 156.02 18.91 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 166.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -148.25 147.34 29.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.979 0.912 . . . . 0.0 110.998 -177.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 52.2 m-70 . . . . . 0 N--CA 1.472 0.626 0 C-N-CA 123.336 0.654 . . . . 0.0 112.036 174.987 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 . . . . . 0 CA--C 1.539 0.519 0 CA-C-O 121.189 0.519 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mm -82.14 130.22 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 123.988 0.915 . . . . 0.0 109.545 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.5 p -143.69 166.77 23.94 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.786 1.634 . . . . 0.0 109.78 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.57 -13.16 27.97 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.853 -1.154 . . . . 0.0 113.345 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -97.91 -13.59 21.12 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.123 1.769 . . . . 0.0 114.417 173.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -126.3 -11.74 6.31 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -60.74 -18.88 57.38 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -62.4 -22.13 65.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.807 1.243 . . . . 0.0 113.112 174.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -75.02 -13.15 60.47 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.062 0.945 . . . . 0.0 113.357 177.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 65.3 mt -73.37 134.48 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.321 1.049 . . . . 0.0 110.079 175.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -126.85 166.38 17.57 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.227 1.811 . . . . 0.0 111.442 174.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -56.92 125.09 20.96 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.761 -0.587 . . . . 0.0 111.321 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.7 9.29 68.89 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.238 1.399 . . . . 0.0 115.343 -176.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 99.0 m -66.0 130.07 41.99 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.498 1.649 . . . . 0.0 111.255 177.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.8 mt -87.0 124.77 40.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 170.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.4 mt -118.21 172.46 7.42 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.239 1.815 . . . . 0.0 110.723 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.7 ttt-85 -132.11 140.38 48.79 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 126.745 2.018 . . . . 0.0 110.049 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.96 140.19 38.07 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 167.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -158.25 152.84 24.69 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.308 -0.87 . . . . 0.0 111.028 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.1 p -73.6 135.15 43.83 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.568 -1.332 . . . . 0.0 110.856 170.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 126.434 1.893 . . . . 0.0 114.421 -168.71 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 ttp -150.32 136.66 10.86 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 125.239 1.415 . . . . 0.0 110.804 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -70.73 162.87 41.05 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.146 2.564 . . . . 0.0 112.911 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.0 153.35 52.16 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 123.535 2.823 . . . . 0.0 113.448 173.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -66.0 149.12 86.29 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.337 2.692 . . . . 0.0 112.521 177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -71.67 155.37 40.57 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.145 0.978 . . . . 0.0 113.105 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.1 p-10 -92.28 19.31 7.17 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.238 1.815 . . . . 0.0 113.664 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 54.1 mt -64.35 138.13 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.504 1.521 . . . . 0.0 109.685 171.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 7.6 m -131.94 129.9 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.029 1.331 . . . . 0.0 112.399 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -76.35 141.61 41.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.123 0.969 . . . . 0.0 111.264 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.87 156.11 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.753 1.621 . . . . 0.0 111.512 -177.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.89 121.58 41.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.669 1.188 . . . . 0.0 109.786 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.9 mt -109.68 125.42 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.224 1.01 . . . . 0.0 110.474 -170.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -81.55 148.28 29.23 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.167 1.387 . . . . 0.0 113.375 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -155.89 142.9 13.6 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 126.108 1.763 . . . . 0.0 110.093 168.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -60.56 140.14 89.67 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.756 2.304 . . . . 0.0 113.823 -177.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.58 12.84 70.69 Favored Glycine 0 CA--C 1.539 1.577 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.96 153.58 48.2 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.173 1.389 . . . . 0.0 112.611 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -69.59 150.07 96.86 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.492 0.717 . . . . 0.0 110.936 169.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -59.66 131.07 38.11 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.39 2.06 . . . . 0.0 113.332 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -80.05 114.51 19.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.721 1.209 . . . . 0.0 110.429 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.36 129.96 35.59 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.282 0.633 . . . . 0.0 109.706 169.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 23.9 ptm -154.68 177.13 11.58 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.117 0.967 . . . . 0.0 111.689 172.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -119.3 124.03 45.67 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.23 1.012 . . . . 0.0 111.211 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.7 mt -90.72 110.06 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 125.531 1.532 . . . . 0.0 108.575 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.1 t0 -83.33 118.3 23.59 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.731 0.813 . . . . 0.0 109.774 169.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -65.47 -12.33 51.59 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.12 -25.19 29.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.597 1.089 . . . . 0.0 113.716 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -78.29 148.76 74.82 Favored Pre-proline 0 N--CA 1.48 1.042 0 C-N-CA 124.455 1.102 . . . . 0.0 112.218 -178.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.44 141.75 47.43 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.888 2.392 . . . . 0.0 110.963 173.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -61.49 -30.96 70.94 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 123.107 0.563 . . . . 0.0 112.293 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -59.45 -43.96 93.06 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.038 0.836 . . . . 0.0 112.53 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.76 81.4 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.944 -0.472 . . . . 0.0 111.985 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.06 -48.43 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.33 0.652 . . . . 0.0 110.432 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -61.39 -38.87 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.619 1.168 . . . . 0.0 111.051 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -59.68 -40.19 87.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.502 0.721 . . . . 0.0 112.174 171.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -71.72 -24.76 61.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.454 1.102 . . . . 0.0 113.618 174.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 23.1 t -68.93 -62.22 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.727 1.149 . . . . 0.0 110.615 169.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.1 p -64.66 -33.64 76.43 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.81 0.844 . . . . 0.0 112.659 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.76 -28.67 68.9 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.827 0.851 . . . . 0.0 112.873 172.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.79 -23.16 68.92 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.333 0.968 . . . . 0.0 114.163 174.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -114.18 12.07 17.68 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.94 1.696 . . . . 0.0 113.296 172.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.0 m 54.88 27.68 9.39 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.982 1.713 . . . . 0.0 114.479 -175.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.4 mt -76.81 127.49 32.85 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.133 1.373 . . . . 0.0 110.57 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.52 164.17 25.64 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.686 1.194 . . . . 0.0 113.462 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 53.64 68.23 0.88 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.313 1.845 . . . . 0.0 113.64 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -60.73 -21.95 63.49 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.072 -1.017 . . . . 0.0 113.496 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -54.98 -28.32 50.81 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 112.923 171.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -77.3 -18.33 57.6 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.399 1.08 . . . . 0.0 113.027 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -98.07 158.74 15.37 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -168.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.03 154.51 42.59 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.702 2.401 . . . . 0.0 110.061 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -87.3 150.49 23.84 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.42 0.629 . . . . 0.0 109.851 168.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -137.14 143.44 42.47 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.411 1.884 . . . . 0.0 109.181 -176.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -75.59 125.81 29.76 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.225 0.61 . . . . 0.0 110.543 171.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -98.2 -31.32 12.15 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.775 0.83 . . . . 0.0 113.205 178.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -70.32 -39.89 74.49 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -176.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.6 t -162.21 176.04 11.04 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.801 1.64 . . . . 0.0 111.111 -178.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.6 p 62.49 -34.21 0.11 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 129.659 3.184 . . . . 0.0 118.506 174.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . 0.286 0.7 OUTLIER 48.85 32.4 3.71 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 126.616 1.966 . . . . 0.0 114.434 -169.728 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.4 m-30 -76.95 122.96 25.61 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.696 0.799 . . . . 0.0 111.771 171.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -61.58 142.22 57.25 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.875 -0.515 . . . . 0.0 110.014 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 38.0 mm -76.32 135.65 26.38 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.664 0.745 . . . . 0.0 110.797 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.4 p -143.3 173.7 11.37 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.586 2.355 . . . . 0.0 109.136 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -57.08 -22.53 40.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -90.0 -52.89 4.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.436 . . . . 0.0 112.161 169.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -68.7 -17.04 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -171.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.31 -28.08 40.0 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.521 1.128 . . . . 0.0 113.665 169.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -72.48 -15.93 61.8 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.203 1.001 . . . . 0.0 113.442 177.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.83 -14.14 59.42 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.902 0.881 . . . . 0.0 112.945 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 60.3 mt -74.8 134.0 30.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 124.556 1.143 . . . . 0.0 110.016 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 168.02 14.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.713 2.005 . . . . 0.0 112.28 174.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.76 123.76 18.43 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.69 -0.631 . . . . 0.0 111.176 174.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.53 34.15 36.57 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.1 0.857 . . . . 0.0 114.084 -172.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.0 m -79.06 132.45 36.62 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.168 1.484 . . . . 0.0 110.716 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mt -86.44 113.21 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.6 mt -109.0 177.18 4.84 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.123 1.769 . . . . 0.0 110.869 176.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.6 ttt85 -145.64 137.93 25.6 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 126.56 1.944 . . . . 0.0 110.294 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.8 tp -82.69 136.98 34.59 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.557 0.743 . . . . 0.0 110.06 171.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.8 t -156.84 152.32 26.7 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.049 0.94 . . . . 0.0 110.834 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.7 p -72.14 135.29 46.14 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.714 -1.241 . . . . 0.0 110.976 172.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 48.1 t -69.12 142.97 93.55 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 125.322 1.449 . . . . 0.0 113.554 -170.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -58.86 -17.59 37.55 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.472 2.781 . . . . 0.0 114.214 168.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.51 -14.46 58.86 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.041 1.336 . . . . 0.0 114.532 174.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.6 tm0? -68.02 -35.56 78.49 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -169.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.38 134.43 52.52 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.718 1.207 . . . . 0.0 112.467 175.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -153.33 162.25 41.49 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.482 1.513 . . . . 0.0 111.602 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -69.28 127.44 33.08 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.582 0.753 . . . . 0.0 111.47 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -82.97 49.0 1.44 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.406 1.482 . . . . 0.0 112.853 -174.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 68.0 mt -70.08 -35.4 74.17 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.733 1.213 . . . . 0.0 113.817 -172.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -147.66 164.83 32.28 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.945 1.698 . . . . 0.0 112.156 -172.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -144.57 141.03 29.16 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.429 1.492 . . . . 0.0 110.915 175.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 35.8 ttp-105 -79.43 64.25 4.27 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.973 1.309 . . . . 0.0 112.192 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 43.7 pt -64.73 -9.72 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.525 1.53 . . . . 0.0 114.388 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -62.44 -12.59 22.68 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.352 1.461 . . . . 0.0 113.76 177.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 89.1 p -63.37 -20.95 65.97 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.399 1.08 . . . . 0.0 113.558 170.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 89.3 p -68.19 -39.14 82.58 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.107 0.963 . . . . 0.0 113.028 176.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.2 t -164.99 133.53 3.34 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.837 1.655 . . . . 0.0 111.109 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 tpt -71.3 -36.43 71.64 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.835 0.854 . . . . 0.0 112.692 178.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -159.01 111.15 2.18 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.307 1.443 . . . . 0.0 110.902 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.82 101.71 5.21 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.919 0.888 . . . . 0.0 111.792 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -68.32 147.91 51.48 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.436 1.094 . . . . 0.0 111.659 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.1 mt -71.85 -31.01 66.06 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.701 0.801 . . . . 0.0 113.041 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.6 mp0 -141.37 155.61 45.9 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.777 2.031 . . . . 0.0 110.739 172.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.86 107.45 4.03 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.447 0.699 . . . . 0.0 110.878 173.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.2 pp -85.03 148.61 26.08 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.193 1.397 . . . . 0.0 112.81 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.54 160.29 36.5 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.468 1.907 . . . . 0.0 111.599 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 52.8 p-10 -136.67 11.02 3.17 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.463 1.505 . . . . 0.0 113.839 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -69.73 130.03 41.23 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.013 1.325 . . . . 0.0 111.173 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -147.34 162.41 39.02 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.557 1.543 . . . . 0.0 111.81 177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 92.3 p -151.45 160.32 43.78 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.188 1.395 . . . . 0.0 112.277 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 63.4 tp -70.75 -34.21 71.62 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.394 1.078 . . . . 0.0 113.087 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 84.5 p -158.64 163.23 37.1 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.479 1.512 . . . . 0.0 112.249 -175.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.4 mmt180 -68.47 152.29 45.61 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.799 1.24 . . . . 0.0 112.374 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.097 1.759 . . . . 0.0 113.222 174.339 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 ttp -150.67 141.5 14.75 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 125.316 1.446 . . . . 0.0 111.057 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.74 151.7 74.77 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.158 2.572 . . . . 0.0 113.89 176.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -69.12 161.18 46.88 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.301 2.667 . . . . 0.0 112.233 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.18 146.86 93.14 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.304 2.669 . . . . 0.0 113.544 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.29 -6.17 58.6 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -82.17 32.6 0.39 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.34 2.256 . . . . 0.0 113.801 -173.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 20.3 mt -119.44 136.12 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 124.903 1.281 . . . . 0.0 111.324 -169.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.0 m -133.41 132.46 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.701 1.6 . . . . 0.0 112.068 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -75.74 138.43 41.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.305 1.042 . . . . 0.0 111.306 175.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.6 m -139.92 157.56 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.351 1.461 . . . . 0.0 111.949 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -111.8 143.58 42.51 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.811 1.244 . . . . 0.0 109.708 168.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.6 mt -130.07 125.1 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.761 0.824 . . . . 0.0 110.622 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -86.63 144.81 26.99 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.587 1.555 . . . . 0.0 112.898 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -154.72 142.8 14.27 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 125.815 1.646 . . . . 0.0 110.415 169.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.34 140.28 75.98 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.733 2.288 . . . . 0.0 113.51 -174.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.77 14.08 69.74 Favored Glycine 0 CA--C 1.539 1.534 0 N-CA-C 115.31 0.884 . . . . 0.0 115.31 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.45 156.62 48.36 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.274 1.429 . . . . 0.0 112.805 -177.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -69.08 150.96 97.37 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.918 0.887 . . . . 0.0 111.396 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.17 125.88 18.08 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.792 2.328 . . . . 0.0 111.914 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -83.65 114.83 21.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.89 0.876 . . . . 0.0 110.523 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.6 mt -81.81 134.49 35.43 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.859 0.864 . . . . 0.0 109.815 169.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ppp? -158.36 178.98 9.57 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.575 1.15 . . . . 0.0 111.607 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -124.88 119.75 29.7 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.414 1.086 . . . . 0.0 111.309 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.1 mt -86.11 114.01 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 125.115 1.366 . . . . 0.0 109.085 174.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -88.8 117.24 27.64 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.004 0.922 . . . . 0.0 109.108 168.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -66.43 -14.47 62.22 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -178.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -88.12 -17.38 31.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.944 1.297 . . . . 0.0 113.906 172.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -79.32 147.01 67.82 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-N 119.628 1.103 . . . . 0.0 111.462 172.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.35 141.48 51.62 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.823 2.349 . . . . 0.0 111.086 175.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -60.96 -30.71 70.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.944 -0.551 . . . . 0.0 112.212 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m -59.92 -43.56 94.82 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.187 0.903 . . . . 0.0 112.734 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -39.32 79.71 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.793 -0.567 . . . . 0.0 111.975 175.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 83.8 mt -63.63 -48.45 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.503 0.721 . . . . 0.0 110.438 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.1 mt -61.58 -38.49 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.334 1.053 . . . . 0.0 110.768 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -59.06 -42.6 90.71 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 119.066 0.848 . . . . 0.0 112.146 170.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -69.01 -30.07 68.38 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.364 1.066 . . . . 0.0 112.974 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.49 -53.51 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 121.46 -0.775 . . . . 0.0 110.612 169.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -60.83 -43.49 98.19 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.776 0.83 . . . . 0.0 112.072 -176.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.88 -29.93 69.85 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.074 0.949 . . . . 0.0 112.891 175.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.99 -23.93 64.29 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.365 0.984 . . . . 0.0 114.295 174.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.4 m0 -115.57 14.21 16.51 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.907 1.683 . . . . 0.0 113.234 172.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.85 28.09 11.93 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.056 1.742 . . . . 0.0 114.346 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.1 mt -74.25 122.99 23.71 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.029 1.331 . . . . 0.0 111.283 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.56 164.56 26.44 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.489 1.116 . . . . 0.0 112.336 172.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.2 m120 54.85 50.58 15.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.243 1.417 . . . . 0.0 113.59 173.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -57.42 -20.69 31.73 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.151 0.98 . . . . 0.0 113.385 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -54.99 -28.83 54.97 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.229 1.412 . . . . 0.0 113.072 171.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -78.9 -16.45 57.01 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.222 1.009 . . . . 0.0 112.989 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -92.78 159.26 15.48 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.76 148.87 34.63 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.089 2.156 . . . . 0.0 110.202 171.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.0 mt -81.5 153.19 26.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.462 0.648 . . . . 0.0 109.586 167.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -150.56 150.28 31.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.495 . . . . 0.0 109.331 -170.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -74.78 134.69 41.77 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.945 -1.097 . . . . 0.0 112.082 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.34 40.21 0.48 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.516 1.127 . . . . 0.0 112.392 173.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -145.15 174.45 11.05 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.295 1.838 . . . . 0.0 111.413 -172.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.7 m -58.12 146.68 32.5 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.805 1.242 . . . . 0.0 112.257 174.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.4 m 64.08 115.11 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 127.089 2.156 . . . . 0.0 113.008 -169.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 -78.78 58.28 2.28 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.1 1.36 . . . . 0.0 113.658 -170.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -65.43 97.71 0.31 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.337 1.055 . . . . 0.0 112.479 174.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -64.89 139.69 58.79 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.612 -0.68 . . . . 0.0 109.772 168.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.3 mm -80.08 131.03 35.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.652 0.739 . . . . 0.0 110.711 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 45.5 p -148.39 171.76 15.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.214 2.206 . . . . 0.0 109.321 -173.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.79 -21.54 60.96 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.905 -1.122 . . . . 0.0 113.288 172.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -84.02 -28.07 27.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.472 1.509 . . . . 0.0 113.564 173.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -109.53 -21.25 12.55 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -170.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.07 -25.15 65.16 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -173.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -62.66 -22.4 66.42 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.693 1.197 . . . . 0.0 113.298 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -74.48 -14.66 60.85 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.913 0.885 . . . . 0.0 113.033 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 69.7 mt -73.26 132.74 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.475 1.11 . . . . 0.0 109.876 174.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -125.8 169.78 12.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 126.28 1.832 . . . . 0.0 112.283 174.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -58.99 128.22 36.12 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.742 -0.599 . . . . 0.0 111.08 173.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.88 8.76 78.88 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.93 1.252 . . . . 0.0 115.417 -175.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.9 m -64.83 133.57 52.21 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 119.643 1.722 . . . . 0.0 111.179 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.3 mt -95.32 121.33 45.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.576 0.75 . . . . 0.0 109.194 170.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.5 mt -113.25 175.2 5.55 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.846 2.058 . . . . 0.0 110.555 177.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -139.07 148.7 43.68 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 126.295 1.838 . . . . 0.0 110.257 169.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.7 tp -89.68 139.53 30.47 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.47 1.108 . . . . 0.0 110.327 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.66 154.41 28.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.206 1.002 . . . . 0.0 110.823 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 29.1 p -73.16 136.7 44.82 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.768 -1.208 . . . . 0.0 110.76 169.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 29.3 t -66.28 141.38 97.25 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 125.057 1.343 . . . . 0.0 112.167 -174.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -62.52 -20.02 69.41 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 122.712 2.275 . . . . 0.0 112.684 172.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -84.89 -12.19 53.98 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 176.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -7.94 30.55 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 -169.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -133.01 9.33 4.13 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.376 1.471 . . . . 0.0 112.69 174.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.15 165.56 13.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.2 1.4 . . . . 0.0 113.141 -177.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -67.04 156.02 37.15 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.245 1.018 . . . . 0.0 110.776 168.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -57.25 121.33 9.87 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.215 1.006 . . . . 0.0 111.285 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -76.46 -39.78 52.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.813 0.845 . . . . 0.0 113.27 -170.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 31.9 p80 -164.07 166.44 21.36 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.061 1.744 . . . . 0.0 111.367 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -152.61 141.01 20.64 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.825 1.25 . . . . 0.0 111.014 170.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.83 92.16 3.94 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.929 1.692 . . . . 0.0 109.6 177.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 81.7 mt -67.91 139.21 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.726 0.81 . . . . 0.0 109.703 176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -81.25 41.35 0.6 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.911 1.284 . . . . 0.0 112.87 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 75.6 p -78.17 -21.61 49.92 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.208 1.403 . . . . 0.0 113.953 -176.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 39.3 p -68.98 121.06 15.86 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.922 1.289 . . . . 0.0 111.924 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 28.4 t -160.35 158.8 30.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.656 1.582 . . . . 0.0 111.396 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.3 tpt -150.77 131.46 14.01 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.316 1.446 . . . . 0.0 111.177 177.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 57.2 p-10 -141.34 -3.17 1.2 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.218 1.407 . . . . 0.0 114.163 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.96 4.7 32.41 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.098 1.359 . . . . 0.0 114.162 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -64.42 139.7 58.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.189 1.396 . . . . 0.0 112.35 -174.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -73.99 46.23 0.23 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.191 2.196 . . . . 0.0 114.386 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -59.7 140.39 56.49 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.744 1.218 . . . . 0.0 113.182 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -154.86 163.32 40.45 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.996 1.719 . . . . 0.0 111.572 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.8 mt -133.29 151.35 51.89 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.716 1.606 . . . . 0.0 111.589 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.5 mtpp -72.42 152.03 42.24 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.81 1.244 . . . . 0.0 111.845 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -70.53 139.25 51.52 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.571 0.748 . . . . 0.0 111.812 172.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 69.4 tp -76.1 120.65 21.68 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.009 0.924 . . . . 0.0 111.266 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -73.11 133.39 44.12 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.508 0.723 . . . . 0.0 111.425 171.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.7 t -160.33 151.0 18.61 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.857 1.263 . . . . 0.0 111.643 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -145.22 -0.65 0.87 Allowed 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 34.5 p -69.74 119.58 14.2 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 121.157 -0.965 . . . . 0.0 111.418 -178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.9 mmp_? 55.34 27.91 10.63 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 126.073 1.749 . . . . 0.0 114.124 -176.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.5 t0 . . . . . 0 C--O 1.254 1.312 0 C-N-CA 125.923 1.689 . . . . 0.0 113.128 177.765 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.536 0 N-CA-C 111.837 -0.505 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptp -67.13 150.58 97.84 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 124.015 0.926 . . . . 0.0 112.618 178.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.65 154.12 74.24 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 123.027 2.485 . . . . 0.0 112.064 173.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.64 152.69 74.41 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 123.313 2.676 . . . . 0.0 112.452 177.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.18 141.48 52.48 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.213 2.609 . . . . 0.0 111.633 175.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.94 143.07 37.95 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.033 0.933 . . . . 0.0 112.7 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -121.99 16.3 10.84 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.967 1.707 . . . . 0.0 112.859 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mt -66.65 139.75 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 125.889 1.675 . . . . 0.0 111.452 -171.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.61 131.59 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.622 1.569 . . . . 0.0 112.272 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -79.08 137.81 37.68 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.734 1.214 . . . . 0.0 110.886 176.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.43 160.17 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.89 1.676 . . . . 0.0 112.341 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.41 116.95 26.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.261 . . . . 0.0 110.356 172.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.2 mt -105.1 126.49 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 123.911 0.885 . . . . 0.0 111.007 -171.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -84.02 142.31 30.56 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.848 1.659 . . . . 0.0 112.849 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -155.27 142.58 13.81 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 125.918 1.687 . . . . 0.0 110.424 169.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.21 145.53 93.41 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.708 2.272 . . . . 0.0 114.008 -175.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.14 12.25 71.73 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.508 0.963 . . . . 0.0 115.508 177.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.5 158.08 43.93 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.279 1.431 . . . . 0.0 112.536 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -70.06 155.21 93.83 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 123.84 0.856 . . . . 0.0 111.52 169.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -59.48 130.0 33.66 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.814 2.342 . . . . 0.0 112.698 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -80.19 106.71 12.4 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.024 0.93 . . . . 0.0 109.982 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 60.4 mt -76.05 125.16 28.61 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.625 0.77 . . . . 0.0 109.401 169.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -153.95 178.26 10.12 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -114.91 125.75 54.0 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.154 0.982 . . . . 0.0 111.152 175.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.3 mt -88.43 108.58 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 170.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -80.87 114.21 19.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.095 0.558 . . . . 0.0 109.774 169.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -68.29 -11.24 59.11 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -76.81 -34.65 57.91 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.373 0.988 . . . . 0.0 112.802 169.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -76.97 145.13 73.36 Favored Pre-proline 0 N--CA 1.481 1.075 0 C-N-CA 125.283 1.433 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.86 142.87 64.54 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.046 2.497 . . . . 0.0 111.17 175.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -59.1 -32.94 70.27 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-O 118.545 -0.74 . . . . 0.0 112.29 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.41 -41.52 85.11 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.64 1.109 . . . . 0.0 112.563 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.97 72.69 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.072 0.549 . . . . 0.0 112.254 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.67 -46.73 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.195 0.598 . . . . 0.0 110.332 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.4 mt -60.42 -38.57 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 125.043 1.337 . . . . 0.0 110.935 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -57.05 -46.92 82.07 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.246 0.93 . . . . 0.0 111.565 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -67.22 -28.57 68.18 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.509 1.124 . . . . 0.0 113.324 177.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.79 -52.33 46.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.523 1.056 . . . . 0.0 110.023 169.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.5 m -61.8 -44.27 97.19 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.901 0.881 . . . . 0.0 111.793 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -59.11 -29.21 67.21 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.12 1.368 . . . . 0.0 112.905 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.07 -23.47 66.02 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 124.401 1.0 . . . . 0.0 114.469 173.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -117.33 13.7 14.59 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.032 1.733 . . . . 0.0 113.23 172.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t 55.52 28.53 11.89 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.115 1.766 . . . . 0.0 114.351 -176.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.5 mt -74.21 125.29 28.07 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.314 1.446 . . . . 0.0 111.458 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.68 163.61 27.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.53 1.132 . . . . 0.0 112.516 174.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 54.25 53.29 11.17 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.637 1.575 . . . . 0.0 113.89 173.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.1 p-80 -58.26 -18.11 24.22 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.171 0.988 . . . . 0.0 113.562 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -55.84 -28.84 58.34 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.986 1.315 . . . . 0.0 113.008 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -79.68 -15.84 56.83 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.03 0.932 . . . . 0.0 112.771 177.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -94.43 159.27 15.18 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 122.625 1.202 . . . . 0.0 114.11 -169.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.32 151.24 36.26 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.396 2.278 . . . . 0.0 110.105 173.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.0 mt -82.33 156.64 24.14 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 166.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -148.87 150.08 32.37 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.649 1.18 . . . . 0.0 110.496 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -67.2 147.24 53.32 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.608 -0.682 . . . . 0.0 112.795 173.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -139.34 -22.49 0.91 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.678 1.191 . . . . 0.0 113.857 173.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -64.07 -41.18 97.43 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.397 0.999 . . . . 0.0 112.792 175.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.2 t -155.84 128.57 7.9 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.588 1.555 . . . . 0.0 109.881 173.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.5 t 57.9 179.91 0.06 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.283 1.433 . . . . 0.0 113.681 -169.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -130.54 38.13 3.77 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.824 2.05 . . . . 0.0 112.027 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -61.19 133.28 55.78 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.309 -0.87 . . . . 0.0 111.076 171.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -69.8 142.18 53.2 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.971 -0.456 . . . . 0.0 110.623 170.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 41.6 mm -81.51 134.21 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.228 1.011 . . . . 0.0 110.307 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -143.95 168.9 18.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.271 1.828 . . . . 0.0 109.661 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -62.21 -13.5 28.38 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.685 -1.259 . . . . 0.0 113.213 174.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -99.07 -6.75 27.86 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.633 1.973 . . . . 0.0 114.282 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.58 -15.97 4.39 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.094 1.358 . . . . 0.0 113.969 -173.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.95 -19.53 62.84 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -62.31 -22.51 66.11 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.843 1.257 . . . . 0.0 112.838 173.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -75.56 -13.45 60.35 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.108 0.963 . . . . 0.0 113.253 176.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.0 mt -74.92 131.26 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.184 0.994 . . . . 0.0 109.603 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -124.61 169.85 11.52 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.912 1.685 . . . . 0.0 111.791 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -57.13 126.1 25.68 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 111.278 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.22 11.06 76.63 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.075 1.322 . . . . 0.0 115.445 -176.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.3 m -67.26 128.8 37.75 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.626 1.713 . . . . 0.0 111.405 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -83.36 126.23 40.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 169.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.7 mt -121.47 175.56 6.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.678 1.991 . . . . 0.0 110.867 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 73.8 ttt-85 -137.53 133.53 34.63 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 127.364 2.266 . . . . 0.0 110.033 176.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.5 tp -81.86 137.48 35.23 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 167.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.0 t -157.08 152.76 26.84 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.134 0.574 . . . . 0.0 111.239 -175.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.1 p -70.62 138.94 51.22 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.131 -0.981 . . . . 0.0 109.304 167.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.5 t -64.17 152.4 88.16 Favored Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 126.022 1.729 . . . . 0.0 112.003 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -72.39 -17.67 26.95 Favored 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 123.043 2.495 . . . . 0.0 112.775 168.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -110.4 -39.58 4.9 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.386 1.474 . . . . 0.0 113.656 -177.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 56.08 32.17 19.53 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.958 1.703 . . . . 0.0 113.82 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -147.51 158.59 44.06 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.907 1.683 . . . . 0.0 111.285 -174.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.24 156.19 36.94 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.638 1.175 . . . . 0.0 113.383 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -147.92 141.86 25.86 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.071 1.748 . . . . 0.0 109.866 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -125.97 -8.69 6.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.045 1.338 . . . . 0.0 114.526 -175.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.2 mp -78.77 94.07 5.07 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.003 0.921 . . . . 0.0 110.534 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -139.0 164.65 29.19 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.924 1.689 . . . . 0.0 112.023 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -112.44 151.85 29.38 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.273 1.429 . . . . 0.0 111.276 174.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -61.93 128.86 38.21 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.933 1.293 . . . . 0.0 111.53 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 89.0 mt -74.9 120.07 23.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.662 0.785 . . . . 0.0 109.037 173.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -146.84 31.19 0.95 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.003 1.321 . . . . 0.0 111.559 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 16.5 m -66.25 154.25 40.39 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.477 1.511 . . . . 0.0 113.232 -176.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 75.7 p -72.87 -8.02 53.61 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.159 1.383 . . . . 0.0 114.668 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.0 t 65.88 160.84 0.14 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.314 2.246 . . . . 0.0 114.745 -175.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -79.86 160.31 26.11 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.685 1.194 . . . . 0.0 113.307 -174.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -128.44 32.71 4.8 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.695 1.598 . . . . 0.0 111.675 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.64 -3.67 45.15 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.371 1.468 . . . . 0.0 114.707 -174.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -65.39 145.74 55.78 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.699 1.2 . . . . 0.0 111.664 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 95.1 mt -129.15 174.41 9.59 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.384 1.874 . . . . 0.0 110.785 174.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -146.49 32.72 0.96 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.985 1.314 . . . . 0.0 112.441 172.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.51 147.15 53.89 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.733 1.213 . . . . 0.0 112.334 174.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.9 mt -140.41 160.37 40.15 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.845 1.658 . . . . 0.0 111.879 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -143.15 -36.1 0.38 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.444 1.498 . . . . 0.0 113.093 176.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -150.48 154.09 37.05 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.773 1.629 . . . . 0.0 110.776 175.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 97.8 mt -130.31 -2.75 4.41 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.809 2.044 . . . . 0.0 113.143 179.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -72.03 -15.87 62.04 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.8 m -63.67 146.04 54.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.11 1.364 . . . . 0.0 113.081 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 96.5 mt -135.84 152.61 51.23 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.98 1.712 . . . . 0.0 111.471 178.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.8 m -143.35 155.83 44.53 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.625 1.57 . . . . 0.0 111.954 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.11 154.21 42.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.468 1.107 . . . . 0.0 112.015 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.0 t0 . . . . . 0 C--O 1.254 1.307 0 C-N-CA 126.119 1.768 . . . . 0.0 111.945 179.792 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.9 mtp -69.24 149.72 97.41 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.159 0.983 . . . . 0.0 112.458 177.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -67.24 157.34 62.22 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 123.443 2.762 . . . . 0.0 112.557 175.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -67.18 154.15 75.2 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.262 2.641 . . . . 0.0 112.374 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.44 64.18 7.25 Favored 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 124.779 3.653 . . . . 0.0 112.507 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 58.2 34.04 23.74 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 126.434 1.894 . . . . 0.0 115.019 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -75.68 9.69 2.15 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.9 mt -132.77 134.97 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.634 1.574 . . . . 0.0 109.589 -177.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 m -134.36 132.45 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.349 1.46 . . . . 0.0 111.489 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -77.16 144.09 38.62 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.53 155.19 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 125.922 1.689 . . . . 0.0 111.391 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.9 112.95 21.02 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.563 1.145 . . . . 0.0 110.331 175.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.2 mt -102.52 126.4 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.909 0.884 . . . . 0.0 111.075 -169.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -82.24 146.87 29.26 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.14 1.776 . . . . 0.0 113.215 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.2 t-105 -154.25 141.39 13.45 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 125.854 1.662 . . . . 0.0 110.232 168.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.54 138.1 73.58 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.664 2.243 . . . . 0.0 113.463 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.07 12.77 72.15 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 115.309 0.883 . . . . 0.0 115.309 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.85 152.96 50.85 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.222 1.409 . . . . 0.0 112.641 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -68.99 150.67 97.54 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 123.898 0.879 . . . . 0.0 111.072 170.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.37 129.68 30.78 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.471 2.114 . . . . 0.0 113.179 -179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -80.57 110.75 16.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.608 1.163 . . . . 0.0 110.36 176.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.3 mt -77.33 126.54 31.09 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.487 0.715 . . . . 0.0 109.818 169.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.0 ptm -155.02 177.46 11.3 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.291 1.036 . . . . 0.0 111.555 173.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.7 mp0 -112.74 136.07 52.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.962 0.905 . . . . 0.0 112.6 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.8 mt -96.78 109.49 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 125.563 1.545 . . . . 0.0 107.914 169.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -84.56 116.84 23.36 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -66.98 -11.78 57.86 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -86.62 -22.54 26.13 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.747 1.219 . . . . 0.0 113.63 170.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -82.12 142.82 48.14 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.324 1.05 . . . . 0.0 111.57 175.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -67.57 144.9 68.39 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.403 2.736 . . . . 0.0 111.621 177.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.5 mt -60.33 -32.67 71.46 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.084 176.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 m -58.85 -42.9 90.43 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.418 1.008 . . . . 0.0 112.583 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.56 -39.4 77.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.067 0.547 . . . . 0.0 111.981 174.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.46 -46.35 95.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 123.523 0.729 . . . . 0.0 110.687 176.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.8 mt -60.84 -38.24 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.93 1.292 . . . . 0.0 111.281 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -62.04 -38.7 89.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.4 0.68 . . . . 0.0 112.251 171.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.34 -24.74 62.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.235 1.014 . . . . 0.0 113.195 173.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.6 t -69.87 -58.04 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 119.604 1.093 . . . . 0.0 110.704 169.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 15.3 p -63.74 -33.52 75.83 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.502 0.721 . . . . 0.0 112.654 -169.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -61.43 -26.98 68.23 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.58 1.152 . . . . 0.0 113.045 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.36 -22.86 71.48 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.279 0.942 . . . . 0.0 114.225 174.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -119.03 11.81 12.56 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.985 1.714 . . . . 0.0 113.27 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 32.4 m 54.5 29.92 12.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.025 1.73 . . . . 0.0 114.376 -175.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.9 mt -77.6 127.03 31.8 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.542 1.137 . . . . 0.0 110.445 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.18 160.6 27.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.522 1.129 . . . . 0.0 113.445 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 51.55 69.11 0.7 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.774 2.03 . . . . 0.0 113.261 170.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -60.56 -18.83 55.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.546 1.138 . . . . 0.0 113.72 -176.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -54.75 -28.28 47.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.227 1.411 . . . . 0.0 112.933 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -78.29 -17.93 55.95 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.859 0.863 . . . . 0.0 113.204 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -99.21 158.58 15.59 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -168.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.79 149.83 33.09 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.597 1.959 . . . . 0.0 110.256 171.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.4 mt -76.56 154.67 34.28 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.445 0.64 . . . . 0.0 109.43 167.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -148.58 156.58 42.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.279 1.831 . . . . 0.0 108.808 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 -66.34 150.66 48.53 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.74 -1.225 . . . . 0.0 111.984 170.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.14 -11.35 60.9 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 178.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -61.19 168.36 2.61 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.549 1.539 . . . . 0.0 112.797 172.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.9 m -66.4 -36.07 81.91 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.524 1.129 . . . . 0.0 113.509 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.1 t -74.16 147.29 42.76 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.869 0.868 . . . . 0.0 112.867 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.2 p-10 -80.8 50.58 1.37 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.976 1.311 . . . . 0.0 114.343 -170.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -71.28 74.17 0.7 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.55 1.14 . . . . 0.0 112.279 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -59.3 135.48 57.66 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.805 0.842 . . . . 0.0 110.713 171.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.4 mm -80.71 134.35 27.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 123.942 0.897 . . . . 0.0 110.586 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -131.78 163.1 28.95 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.38 1.872 . . . . 0.0 111.029 -176.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -61.7 -16.24 47.33 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -86.04 -52.68 5.54 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.938 1.295 . . . . 0.0 112.693 169.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -86.67 -12.24 48.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -169.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.8 ptm180 -54.64 -23.42 17.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.972 1.309 . . . . 0.0 114.269 173.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -65.35 -18.61 65.45 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.11 1.364 . . . . 0.0 113.363 175.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -80.59 -12.68 59.48 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.497 1.119 . . . . 0.0 113.533 173.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -71.0 134.26 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.902 0.881 . . . . 0.0 109.776 175.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -121.38 165.26 15.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.501 1.52 . . . . 0.0 112.219 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -60.53 123.16 16.55 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.001 0.52 . . . . 0.0 110.985 177.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.43 11.0 63.08 Favored Glycine 0 CA--C 1.539 1.537 0 C-N-CA 125.259 1.409 . . . . 0.0 115.476 -174.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.3 m -66.15 129.71 40.73 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 119.729 1.765 . . . . 0.0 110.973 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.2 mt -85.11 125.18 40.39 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.7 mt -119.06 -179.42 3.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.682 1.993 . . . . 0.0 110.714 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.5 ttp-105 -145.89 135.47 23.21 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 127.637 2.375 . . . . 0.0 110.09 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.5 tp -84.45 138.25 32.92 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.592 0.757 . . . . 0.0 109.827 169.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.2 t -160.15 155.55 25.25 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.996 0.918 . . . . 0.0 110.369 -177.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.0 p -70.33 148.82 48.02 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.743 -1.223 . . . . 0.0 111.183 170.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 4.5 p -62.14 159.38 38.93 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 124.77 1.228 . . . . 0.0 113.916 -171.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.54 -23.43 57.37 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 122.291 1.994 . . . . 0.0 112.829 176.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.53 -39.81 57.83 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.419 1.088 . . . . 0.0 112.374 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 66.3 mm-40 -66.7 -34.13 77.17 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.567 -0.708 . . . . 0.0 112.358 174.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -77.93 -5.7 51.99 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.311 1.044 . . . . 0.0 113.795 171.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . 60.05 -26.59 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 130.043 3.337 . . . . 0.0 117.856 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -76.67 -16.91 59.41 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.693 1.597 . . . . 0.0 113.652 -174.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 47.68 46.26 18.09 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.52 1.928 . . . . 0.0 115.213 170.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.453 ' H ' HD22 ' A' ' 88' ' ' LEU . 2.3 mm? -61.68 143.69 55.75 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.423 1.089 . . . . 0.0 111.944 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -138.16 -11.83 1.45 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.096 1.358 . . . . 0.0 113.313 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -70.73 115.03 9.41 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.75 2.02 . . . . 0.0 111.159 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -64.74 129.55 40.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.978 0.911 . . . . 0.0 111.327 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 71.6 mt -82.87 113.65 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 123.53 0.732 . . . . 0.0 109.41 178.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -78.54 -23.56 46.13 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.382 1.073 . . . . 0.0 113.363 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 29.2 t -69.49 143.16 53.58 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.393 1.077 . . . . 0.0 112.858 -178.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.7 t -154.62 141.2 18.88 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.485 1.514 . . . . 0.0 111.204 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.6 t -77.62 -40.72 41.03 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.013 0.925 . . . . 0.0 113.451 -176.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 46.3 ttp -157.64 154.95 29.23 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.188 1.395 . . . . 0.0 111.621 -174.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -64.32 -14.83 58.44 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -175.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -143.71 150.23 38.36 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.84 1.656 . . . . 0.0 110.957 173.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -99.13 138.71 35.84 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.738 1.215 . . . . 0.0 111.697 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.8 mp -137.93 148.63 45.45 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.827 1.651 . . . . 0.0 110.825 176.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -142.81 149.87 39.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.781 1.632 . . . . 0.0 111.3 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.14 143.89 47.13 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.724 0.809 . . . . 0.0 112.526 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.0 mt -125.1 19.55 8.31 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.738 1.615 . . . . 0.0 112.834 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -66.81 148.67 51.63 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.164 1.386 . . . . 0.0 112.213 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.9 133.06 48.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.841 0.856 . . . . 0.0 112.11 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.89 145.64 36.09 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.129 0.972 . . . . 0.0 111.716 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -70.87 141.96 51.21 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.796 0.838 . . . . 0.0 112.241 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.6 t -159.96 157.98 29.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.28 1.432 . . . . 0.0 111.617 178.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 98.3 mt -132.27 106.96 8.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.838 1.655 . . . . 0.0 110.046 175.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 18.5 m -79.99 -15.06 58.02 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -176.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 95.8 mtm-85 -73.33 152.04 41.05 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.146 1.378 . . . . 0.0 112.819 -177.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 . . . . . 0 C--O 1.255 1.343 0 C-N-CA 127.426 2.29 . . . . 0.0 114.319 177.755 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 112.143 -0.383 . . . . 0.0 112.143 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -66.48 150.31 97.36 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.095 0.958 . . . . 0.0 112.658 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.05 157.13 63.16 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.202 2.601 . . . . 0.0 112.512 175.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.73 155.86 68.56 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 123.475 2.783 . . . . 0.0 112.424 175.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -66.87 148.79 82.87 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.428 2.752 . . . . 0.0 112.716 178.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.06 164.65 26.3 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.626 1.17 . . . . 0.0 112.944 175.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -77.29 63.87 2.58 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.759 1.624 . . . . 0.0 112.371 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.9 mt -108.05 137.39 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.347 1.459 . . . . 0.0 111.114 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.3 m -133.11 135.05 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.636 1.574 . . . . 0.0 111.928 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -76.11 142.52 41.66 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.078 0.951 . . . . 0.0 111.676 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.7 m -142.34 157.31 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.563 1.545 . . . . 0.0 111.889 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.06 123.09 43.62 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.869 1.268 . . . . 0.0 110.029 171.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -111.09 126.09 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.02 0.928 . . . . 0.0 110.836 -170.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -83.54 142.23 31.03 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.033 1.733 . . . . 0.0 112.733 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -155.06 142.72 14.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.89 1.676 . . . . 0.0 110.535 170.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -63.32 142.98 88.03 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.681 2.254 . . . . 0.0 113.78 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.05 13.83 70.23 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 177.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.0 157.45 45.32 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.198 1.399 . . . . 0.0 112.645 -176.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -69.05 152.46 96.77 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.826 0.85 . . . . 0.0 111.411 170.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -60.33 128.4 26.07 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.737 2.291 . . . . 0.0 112.36 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -81.25 111.22 17.46 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.939 0.895 . . . . 0.0 110.283 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -78.32 128.69 34.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.579 0.752 . . . . 0.0 109.592 169.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.1 ptm -154.99 178.59 10.02 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.706 0.802 . . . . 0.0 112.418 174.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 -112.08 129.74 56.12 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.791 1.237 . . . . 0.0 111.481 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.9 mt -97.76 111.76 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 125.259 1.424 . . . . 0.0 108.362 170.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -85.95 117.36 24.75 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.966 -0.754 . . . . 0.0 108.966 169.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -66.24 -14.76 62.45 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.1 tptt -80.78 -30.81 35.96 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.139 1.375 . . . . 0.0 113.664 171.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -73.55 143.22 82.0 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 124.188 0.995 . . . . 0.0 111.377 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.85 142.39 62.75 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.015 2.477 . . . . 0.0 111.108 177.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -59.36 -32.43 70.11 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.539 -0.744 . . . . 0.0 112.173 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m -58.51 -41.86 86.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.624 1.102 . . . . 0.0 112.76 176.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.78 -40.9 72.31 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.064 0.546 . . . . 0.0 112.127 175.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.61 -46.09 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.399 0.68 . . . . 0.0 110.533 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.36 -37.34 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.826 1.251 . . . . 0.0 110.969 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -61.26 -41.94 97.78 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.477 1.035 . . . . 0.0 112.243 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -66.84 -28.51 68.41 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.392 1.077 . . . . 0.0 112.959 174.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.0 -54.29 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.374 0.988 . . . . 0.0 110.177 168.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -61.22 -41.77 97.44 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.222 1.009 . . . . 0.0 112.137 -174.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.05 -29.85 68.8 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.142 0.977 . . . . 0.0 112.925 175.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.91 -23.35 65.59 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.348 0.975 . . . . 0.0 114.403 174.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -117.54 14.41 14.53 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.982 1.713 . . . . 0.0 113.177 172.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.67 28.58 12.28 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.099 1.76 . . . . 0.0 114.337 -177.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.6 mt -74.79 127.36 32.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.17 1.388 . . . . 0.0 111.622 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.63 165.51 24.18 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.689 1.196 . . . . 0.0 112.461 173.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 53.96 54.77 9.24 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.558 1.543 . . . . 0.0 113.629 173.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -58.31 -21.2 48.31 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.928 0.891 . . . . 0.0 112.987 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -56.61 -28.14 59.75 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.548 1.539 . . . . 0.0 112.827 175.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -80.63 -17.5 51.08 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.967 0.907 . . . . 0.0 112.748 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -90.77 159.9 16.07 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.539 1.162 . . . . 0.0 113.869 -170.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.24 151.27 37.31 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.789 2.436 . . . . 0.0 109.828 172.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.7 mt -82.92 158.61 22.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 166.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -149.4 145.64 27.06 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 124.648 1.179 . . . . 0.0 110.494 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.0 m-70 -68.26 129.08 38.84 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.67 -0.644 . . . . 0.0 110.996 171.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -89.43 -6.02 56.89 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -146.43 161.19 40.95 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.301 1.44 . . . . 0.0 111.812 -175.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.8 m 63.15 -47.39 0.22 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 128.699 2.799 . . . . 0.0 115.453 -172.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.5 t -160.4 149.16 16.93 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.639 1.576 . . . . 0.0 111.205 170.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -78.99 36.45 0.28 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.502 1.521 . . . . 0.0 114.028 -175.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -63.19 127.41 31.14 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.873 -1.142 . . . . 0.0 112.305 -178.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -70.28 143.12 52.18 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.133 0.573 . . . . 0.0 110.377 169.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 44.0 mm -83.82 133.86 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.77 1.228 . . . . 0.0 110.549 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.3 p -144.55 165.73 27.16 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 127.005 2.122 . . . . 0.0 110.178 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.19 -11.91 17.13 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 121.041 -1.037 . . . . 0.0 113.344 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -90.46 -20.96 22.13 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.765 1.626 . . . . 0.0 114.585 176.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -135.51 -2.41 2.45 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -173.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.49 -22.16 12.08 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 175.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -62.59 -18.49 62.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.172 1.389 . . . . 0.0 113.415 175.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -73.38 -14.72 61.33 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.5 mt -72.87 128.82 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 123.92 0.888 . . . . 0.0 109.601 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -120.13 174.56 6.41 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.112 1.765 . . . . 0.0 112.246 172.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -57.52 130.46 46.42 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.907 -0.495 . . . . 0.0 111.24 170.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.56 10.93 83.77 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 124.71 1.148 . . . . 0.0 115.367 -177.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 90.3 m -65.67 129.65 40.5 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.618 1.709 . . . . 0.0 110.967 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 35.1 mt -86.28 122.07 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 170.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.3 mt -118.57 174.66 6.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.155 1.782 . . . . 0.0 111.082 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.2 ttt-85 -138.57 135.07 34.63 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 127.338 2.255 . . . . 0.0 109.851 178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.0 tp -83.24 136.66 34.32 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.048 0.539 . . . . 0.0 109.651 168.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.1 t -158.26 149.26 20.78 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.776 0.83 . . . . 0.0 110.82 -174.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.6 p -71.54 132.97 45.45 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.655 -1.278 . . . . 0.0 110.627 170.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.8 t -61.56 142.21 94.34 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 125.125 1.37 . . . . 0.0 112.196 -176.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -65.14 -14.05 43.07 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.965 2.443 . . . . 0.0 112.906 172.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 10.81 28.91 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.292 1.837 . . . . 0.0 114.035 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.38 151.4 28.05 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.241 -0.912 . . . . 0.0 113.448 -177.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.69 161.5 37.1 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.425 1.49 . . . . 0.0 110.802 177.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.13 145.85 55.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.295 0.638 . . . . 0.0 111.513 170.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -69.04 122.61 19.06 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.734 0.814 . . . . 0.0 111.446 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -91.26 -16.04 28.22 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -169.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 41.0 tp -144.82 -48.75 0.25 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -174.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 45.3 m170 -86.61 40.71 0.91 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.26 1.424 . . . . 0.0 112.661 -176.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.8 tt0 -74.59 74.23 1.99 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.669 1.588 . . . . 0.0 113.381 -170.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 36.6 ttp85 56.43 28.24 13.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 127.143 2.177 . . . . 0.0 115.617 169.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -64.13 128.95 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.018 0.927 . . . . 0.0 110.535 -179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -83.71 45.37 1.06 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.44 1.496 . . . . 0.0 112.726 -177.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 78.9 p -74.93 -20.91 59.49 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.134 1.374 . . . . 0.0 114.172 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 31.0 t -69.66 129.54 39.91 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.291 1.036 . . . . 0.0 112.02 179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 38.9 m -72.24 146.5 47.23 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.628 1.171 . . . . 0.0 113.267 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.9 ptm -70.79 162.07 29.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.986 0.915 . . . . 0.0 112.085 169.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -68.17 131.14 44.87 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.666 -0.646 . . . . 0.0 111.658 172.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -76.9 148.16 36.6 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.987 0.915 . . . . 0.0 112.609 177.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -73.74 149.98 41.45 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.474 1.11 . . . . 0.0 111.626 172.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.1 mt -72.99 149.6 43.16 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.012 0.925 . . . . 0.0 111.735 174.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -143.38 157.13 44.71 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.586 1.554 . . . . 0.0 111.933 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.15 157.55 35.11 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.091 0.956 . . . . 0.0 112.622 173.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.94 136.95 56.14 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.889 0.875 . . . . 0.0 111.904 178.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.2 mmtm -141.09 26.29 2.03 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.558 1.943 . . . . 0.0 112.354 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -75.29 -21.67 58.3 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.988 1.315 . . . . 0.0 113.484 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 60.4 tp -67.98 134.8 51.34 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.798 1.239 . . . . 0.0 111.533 174.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -150.25 166.13 30.87 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.309 1.444 . . . . 0.0 112.045 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.2 t -150.37 137.2 19.17 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.287 1.435 . . . . 0.0 110.89 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 94.8 mt -136.31 156.87 48.03 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.937 1.695 . . . . 0.0 111.824 -176.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.6 t -62.96 -18.32 63.04 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -69.85 -25.09 63.57 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.972 1.709 . . . . 0.0 113.543 173.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.402 1.481 . . . . 0.0 114.042 -174.397 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.645 0 N-CA-C 111.806 -0.517 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.9 mtm -69.13 147.83 97.58 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 123.856 0.863 . . . . 0.0 112.295 177.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -61.22 147.97 94.17 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 123.097 2.531 . . . . 0.0 113.61 176.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.37 156.44 61.75 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 123.338 2.692 . . . . 0.0 112.131 173.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -67.0 144.45 70.04 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.139 2.559 . . . . 0.0 111.937 174.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.86 152.42 33.38 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.957 0.903 . . . . 0.0 112.615 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -79.91 51.25 1.3 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.025 1.33 . . . . 0.0 112.204 175.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.1 mt -127.66 136.33 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.329 1.452 . . . . 0.0 109.973 -172.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.7 m -133.2 131.71 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.23 1.412 . . . . 0.0 111.945 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -77.46 138.58 39.33 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.957 0.903 . . . . 0.0 111.168 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.2 m -137.47 157.07 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.7 1.6 . . . . 0.0 111.62 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.91 132.4 55.33 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.266 1.026 . . . . 0.0 109.886 169.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.0 mt -121.28 123.55 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.042 0.937 . . . . 0.0 110.628 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -82.46 143.85 30.86 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.151 1.381 . . . . 0.0 112.899 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.8 t-105 -156.09 143.8 14.07 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.915 1.686 . . . . 0.0 110.161 169.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -62.77 144.98 94.71 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.665 2.243 . . . . 0.0 113.918 -175.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.0 11.48 74.46 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.512 0.965 . . . . 0.0 115.512 177.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.82 155.66 44.21 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.192 1.397 . . . . 0.0 112.585 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -70.09 152.53 95.77 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 123.507 0.723 . . . . 0.0 110.955 169.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -59.21 130.76 37.59 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.45 2.1 . . . . 0.0 113.408 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -78.47 118.09 20.29 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.726 1.21 . . . . 0.0 110.488 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.0 mt -81.1 131.48 35.3 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.292 0.637 . . . . 0.0 109.404 168.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.8 ptm -155.73 176.71 12.26 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.145 0.978 . . . . 0.0 111.644 172.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -115.31 129.82 56.72 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.149 0.98 . . . . 0.0 111.745 176.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.8 mt -95.44 112.36 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 125.8 1.64 . . . . 0.0 108.504 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -86.32 116.99 24.84 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.353 1.061 . . . . 0.0 109.966 171.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -68.2 -13.36 62.18 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.5 mmtm -78.76 -31.03 46.02 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.338 0.972 . . . . 0.0 113.184 169.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -77.03 144.88 72.73 Favored Pre-proline 0 N--CA 1.48 1.034 0 C-N-CA 123.984 0.914 . . . . 0.0 112.042 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.2 143.26 70.43 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.124 2.55 . . . . 0.0 111.214 175.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.34 -30.28 69.43 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 118.117 -0.944 . . . . 0.0 112.672 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.1 t -57.97 -47.14 83.84 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.246 1.385 . . . . 0.0 112.097 173.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.62 -40.34 95.32 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.63 -0.669 . . . . 0.0 112.13 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 94.3 mt -67.1 -45.93 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.672 0.789 . . . . 0.0 110.815 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.8 mt -61.36 -35.82 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.646 1.179 . . . . 0.0 110.645 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 tttp -62.55 -41.16 98.72 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.12 0.873 . . . . 0.0 112.394 171.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -65.37 -30.44 71.27 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.234 1.014 . . . . 0.0 113.101 172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.59 -54.52 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 119.375 0.989 . . . . 0.0 110.247 169.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.3 m -61.36 -42.47 98.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.444 1.098 . . . . 0.0 112.089 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -60.2 -29.53 68.78 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.11 0.964 . . . . 0.0 112.859 175.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.61 -23.37 64.97 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.49 1.043 . . . . 0.0 114.364 174.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.57 16.09 14.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.939 1.696 . . . . 0.0 113.14 172.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.9 p 56.19 21.21 5.06 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.241 2.217 . . . . 0.0 115.505 -176.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.35 126.86 30.94 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.428 1.491 . . . . 0.0 111.649 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.87 164.33 24.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.697 1.199 . . . . 0.0 112.388 173.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 52.98 62.01 2.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.74 1.616 . . . . 0.0 113.464 173.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -61.17 -19.19 61.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.807 0.843 . . . . 0.0 112.808 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -53.25 -30.14 36.57 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.005 1.722 . . . . 0.0 113.198 170.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -76.69 -14.84 59.92 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.142 0.977 . . . . 0.0 113.046 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -102.38 158.55 16.12 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.886 1.275 . . . . 0.0 114.247 -168.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.77 150.97 39.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.258 2.223 . . . . 0.0 109.852 169.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.93 154.58 26.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 166.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -145.11 143.71 30.53 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.516 1.126 . . . . 0.0 109.896 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.7 m-70 -66.15 145.03 56.28 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.659 -0.651 . . . . 0.0 111.699 174.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.63 -18.93 2.13 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -178.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.8 p30 -85.54 2.96 42.68 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.957 1.466 . . . . 0.0 114.957 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.1 t -146.31 -63.24 0.31 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.091 0.957 . . . . 0.0 112.726 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -158.65 161.46 37.16 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.19 1.396 . . . . 0.0 110.984 175.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -74.54 43.53 0.19 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.767 2.027 . . . . 0.0 115.02 -169.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -67.97 125.83 27.54 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 120.716 -1.24 . . . . 0.0 111.08 174.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -68.08 142.31 55.86 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.492 -0.755 . . . . 0.0 111.388 172.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -80.99 137.53 21.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.1 0.96 . . . . 0.0 110.109 174.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 15.5 p -144.28 168.43 20.07 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.507 1.923 . . . . 0.0 109.447 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -63.78 -4.19 2.97 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 177.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -118.89 -15.61 9.34 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.389 1.476 . . . . 0.0 114.662 169.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -90.12 -22.71 21.64 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.86 1.209 . . . . 0.0 113.633 173.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -59.4 -19.82 50.16 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -173.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -63.64 -24.61 67.86 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.332 1.053 . . . . 0.0 113.056 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -74.83 -16.08 60.71 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.834 0.854 . . . . 0.0 113.097 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.6 mt -71.06 133.33 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.102 0.961 . . . . 0.0 109.841 173.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -129.7 171.37 12.72 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 126.364 1.865 . . . . 0.0 111.328 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -60.24 121.32 11.66 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.911 -0.493 . . . . 0.0 110.312 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.16 8.56 81.61 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.849 1.214 . . . . 0.0 115.459 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.3 m -63.38 130.72 45.64 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.893 1.847 . . . . 0.0 110.564 173.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mt -91.65 123.61 43.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 123.351 0.66 . . . . 0.0 109.425 173.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.4 mt -114.96 174.27 6.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.556 1.942 . . . . 0.0 110.943 177.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -137.49 136.05 37.36 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 127.082 2.153 . . . . 0.0 109.745 173.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.0 tp -79.47 136.72 37.0 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.25 0.62 . . . . 0.0 110.009 169.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.6 t -155.07 147.53 24.07 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.564 0.746 . . . . 0.0 111.036 -176.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -71.23 130.62 41.89 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.879 -1.138 . . . . 0.0 110.532 171.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.7 p -73.6 157.59 87.45 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.231 1.412 . . . . 0.0 114.371 -168.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -69.98 -20.64 33.53 Favored 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 122.505 2.136 . . . . 0.0 112.12 169.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.27 4.79 8.06 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.904 1.681 . . . . 0.0 114.882 179.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.36 -36.86 81.36 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.773 -1.204 . . . . 0.0 112.879 172.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -76.78 -40.11 49.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.791 0.836 . . . . 0.0 113.085 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -158.57 158.4 33.86 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.067 1.747 . . . . 0.0 110.756 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -71.89 74.94 0.89 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.818 1.247 . . . . 0.0 112.24 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -71.63 -21.69 61.8 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.911 1.684 . . . . 0.0 114.11 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.5 mt -67.22 152.57 45.5 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.041 1.336 . . . . 0.0 112.879 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -68.88 163.39 24.44 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.153 1.381 . . . . 0.0 112.999 175.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -68.87 122.43 18.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.686 0.794 . . . . 0.0 111.249 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.1 82.98 6.06 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.128 0.971 . . . . 0.0 111.483 -175.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 40.7 pt -62.9 148.15 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.918 0.887 . . . . 0.0 111.782 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -82.37 -25.2 34.02 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.679 0.791 . . . . 0.0 112.652 173.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.4 m -68.28 139.83 55.97 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.908 1.283 . . . . 0.0 112.865 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 24.7 t -76.43 161.61 28.53 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.189 0.996 . . . . 0.0 112.084 171.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.8 m -73.28 59.85 0.58 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.692 1.597 . . . . 0.0 111.341 169.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.6 ptm -80.73 5.25 16.32 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.442 1.897 . . . . 0.0 115.539 -169.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 49.5 p-10 -68.7 -12.19 61.11 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -148.86 142.95 25.93 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.393 1.877 . . . . 0.0 110.515 169.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -155.03 146.86 23.41 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.623 1.169 . . . . 0.0 112.625 -176.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.4 tp -145.07 126.29 14.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.77 2.028 . . . . 0.0 108.603 168.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -71.6 -49.48 39.91 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -164.71 161.21 20.54 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.903 1.681 . . . . 0.0 111.736 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.0 mt -75.22 154.95 37.32 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.939 0.896 . . . . 0.0 110.649 168.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -64.52 146.22 54.92 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 113.21 0.818 . . . . 0.0 113.21 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.1 p-10 -92.24 -17.8 24.31 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.344 1.458 . . . . 0.0 112.932 169.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 81.0 mt -71.46 146.54 48.56 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.965 1.306 . . . . 0.0 112.267 177.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.76 150.0 49.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.442 0.697 . . . . 0.0 111.733 172.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.2 m -75.57 -11.04 59.94 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 87.5 mt -71.92 146.16 48.0 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.003 1.321 . . . . 0.0 111.969 174.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 29.3 t -65.46 -21.85 66.69 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.279 1.032 . . . . 0.0 113.616 177.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 58.3 ttp180 -64.82 -30.35 71.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.825 1.65 . . . . 0.0 114.219 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 51.2 t0 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 125.23 1.412 . . . . 0.0 113.18 -178.742 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.602 0 N-CA-C 111.931 -0.468 . . . . 0.0 111.931 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.8 mmm -70.32 155.85 92.79 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 123.95 0.9 . . . . 0.0 112.706 177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -60.84 161.47 21.68 Favored 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 123.499 2.799 . . . . 0.0 113.987 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -58.03 151.15 60.0 Favored 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 123.645 2.897 . . . . 0.0 113.659 175.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -68.64 151.67 74.86 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.442 2.762 . . . . 0.0 112.569 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.72 37.06 0.17 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.713 1.605 . . . . 0.0 114.183 -178.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -78.73 45.16 0.58 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.35 1.86 . . . . 0.0 113.05 -176.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.6 mt -128.41 135.66 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 125.098 1.359 . . . . 0.0 110.51 -170.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -134.37 133.33 55.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.434 1.494 . . . . 0.0 111.883 -176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -75.05 142.15 43.78 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.121 0.969 . . . . 0.0 110.767 174.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m -141.55 156.77 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.807 1.643 . . . . 0.0 111.223 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.75 124.77 50.44 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.376 1.07 . . . . 0.0 110.269 171.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mt -112.46 123.76 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.334 1.054 . . . . 0.0 110.761 -170.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -79.55 144.34 34.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 112.817 174.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -154.65 143.29 14.65 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 125.777 1.631 . . . . 0.0 110.359 169.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -63.88 142.1 80.73 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.592 2.195 . . . . 0.0 113.6 -173.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.52 70.94 Favored Glycine 0 CA--C 1.539 1.533 0 N-CA-C 115.378 0.911 . . . . 0.0 115.378 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.16 154.91 46.1 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.259 1.424 . . . . 0.0 112.558 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -70.15 151.71 95.91 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 123.692 0.797 . . . . 0.0 111.177 169.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -59.43 130.64 36.6 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.502 2.135 . . . . 0.0 113.377 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -80.22 117.9 21.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.544 1.137 . . . . 0.0 110.637 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt -79.73 130.84 35.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 168.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.5 ptm -154.57 179.51 8.97 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.296 1.038 . . . . 0.0 111.226 171.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -122.25 125.74 46.7 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.137 0.975 . . . . 0.0 111.753 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.4 mt -89.78 116.74 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 C-N-CA 125.638 1.575 . . . . 0.0 108.932 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -89.9 113.25 24.83 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.088 1.355 . . . . 0.0 109.715 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -69.61 -11.7 61.05 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -88.97 -15.99 32.84 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.51 1.124 . . . . 0.0 113.79 170.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -79.06 149.04 72.73 Favored Pre-proline 0 N--CA 1.481 1.103 0 CA-C-N 119.831 1.196 . . . . 0.0 112.203 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.48 146.25 84.64 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.899 2.4 . . . . 0.0 110.984 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 mt -63.49 -27.94 69.62 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 118.529 -0.748 . . . . 0.0 112.264 178.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.5 t -59.0 -45.99 89.29 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.663 1.119 . . . . 0.0 112.423 171.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.48 99.25 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.584 -0.697 . . . . 0.0 112.078 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 53.3 mt -65.18 -49.02 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.595 0.758 . . . . 0.0 110.877 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.7 mt -61.74 -36.31 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.122 0.969 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.31 -43.62 92.63 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.114 0.87 . . . . 0.0 112.21 170.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -66.94 -27.53 67.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.362 1.065 . . . . 0.0 113.079 174.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 16.0 t -68.37 -57.48 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 CA-C-N 119.576 1.08 . . . . 0.0 110.358 169.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.6 m -60.98 -40.86 95.09 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.259 1.024 . . . . 0.0 112.522 -173.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -61.12 -27.66 68.54 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.45 -23.68 68.71 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.391 0.996 . . . . 0.0 114.413 174.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -116.27 16.03 15.85 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.802 1.641 . . . . 0.0 113.146 172.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 m 55.22 26.6 8.62 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.977 1.711 . . . . 0.0 114.557 -177.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.2 mt -73.57 125.33 27.73 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.079 1.352 . . . . 0.0 111.164 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.6 155.7 37.55 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.404 1.081 . . . . 0.0 112.507 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 49.46 71.6 0.37 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.62 1.968 . . . . 0.0 113.144 173.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 -60.85 -16.99 47.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.472 1.109 . . . . 0.0 112.944 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -52.07 -29.36 21.07 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.155 1.782 . . . . 0.0 113.101 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -75.51 -15.24 60.42 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.12 160.74 14.6 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -167.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.68 150.21 38.37 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.995 2.118 . . . . 0.0 110.127 169.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.05 154.48 28.11 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 166.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -147.43 147.13 29.9 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.676 1.19 . . . . 0.0 110.456 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 -67.98 132.87 48.1 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.448 -0.783 . . . . 0.0 110.945 171.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.94 -19.22 60.75 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -65.58 166.24 10.93 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.717 1.207 . . . . 0.0 112.659 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.8 p -60.76 -16.28 38.6 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.085 1.354 . . . . 0.0 114.611 -176.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 79.4 p -62.29 -31.96 72.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.074 1.35 . . . . 0.0 113.232 170.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 51.6 30.86 7.0 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.157 1.783 . . . . 0.0 114.547 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -64.75 127.4 31.4 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 120.885 -1.135 . . . . 0.0 111.819 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -68.3 141.96 55.69 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.943 -0.473 . . . . 0.0 110.453 169.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 40.2 mm -78.08 132.26 32.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.884 0.874 . . . . 0.0 110.443 176.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.5 p -139.4 164.94 28.53 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.875 1.67 . . . . 0.0 111.232 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -63.75 -6.76 6.13 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.802 1.241 . . . . 0.0 113.608 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -107.31 -8.08 16.49 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.169 1.788 . . . . 0.0 114.021 176.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -134.02 -5.28 2.74 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -55.9 -23.81 33.68 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -62.05 -21.72 65.15 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.251 1.42 . . . . 0.0 113.272 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -74.63 -14.17 60.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.012 0.925 . . . . 0.0 112.999 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 73.2 mt -71.55 130.61 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.046 0.938 . . . . 0.0 109.428 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -123.08 168.89 11.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.093 1.757 . . . . 0.0 112.255 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -60.86 123.41 17.46 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.768 -0.583 . . . . 0.0 110.942 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.71 11.3 64.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.268 1.413 . . . . 0.0 115.557 -174.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.2 m -65.73 131.87 47.37 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.704 1.752 . . . . 0.0 111.058 176.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mt -87.27 121.65 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -118.28 178.79 4.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.597 1.959 . . . . 0.0 110.551 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -144.44 136.32 26.0 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 126.759 2.023 . . . . 0.0 109.936 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.7 tp -82.77 138.15 34.12 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.131 0.572 . . . . 0.0 109.885 169.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.3 t -154.77 151.3 28.52 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.996 0.918 . . . . 0.0 110.409 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.4 p -68.9 131.81 45.7 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.89 -1.131 . . . . 0.0 110.396 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.8 t -62.08 153.42 74.09 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.808 2.043 . . . . 0.0 112.79 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -71.91 -16.45 29.3 Favored 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 122.945 2.43 . . . . 0.0 113.091 168.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -114.72 -32.15 5.92 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.524 1.53 . . . . 0.0 114.02 -177.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 56.29 -148.69 0.48 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.73 1.612 . . . . 0.0 113.001 172.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -63.28 -13.21 35.88 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -177.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -77.95 -9.86 59.3 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 171.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 42.5 tp60 -63.72 120.46 11.87 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.427 1.091 . . . . 0.0 111.873 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -82.03 -39.44 23.52 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -176.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 77.5 mt -101.15 134.61 43.91 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.425 1.49 . . . . 0.0 112.695 -172.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -137.25 22.78 2.99 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.531 1.933 . . . . 0.0 111.868 -177.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.52 156.41 38.04 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.098 2.559 . . . . 0.0 109.793 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 16.0 tpt85 -76.35 98.19 4.45 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.259 -0.9 . . . . 0.0 110.279 175.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 49.6 mm -70.82 106.06 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.917 0.887 . . . . 0.0 109.842 174.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -160.92 163.26 32.02 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.607 1.963 . . . . 0.0 110.99 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 46.9 t -74.17 -42.04 60.52 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.883 0.873 . . . . 0.0 111.156 169.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 28.2 t -76.75 166.33 23.51 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.202 1.401 . . . . 0.0 112.108 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.8 m -64.46 -30.48 71.52 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.133 -0.979 . . . . 0.0 112.749 170.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -160.04 157.55 28.86 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.908 1.683 . . . . 0.0 111.5 175.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 46.3 p-10 -132.37 -4.3 3.4 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.049 1.339 . . . . 0.0 114.559 -178.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 130.75 43.9 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.664 1.186 . . . . 0.0 112.993 -175.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -164.12 164.76 22.7 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.997 2.119 . . . . 0.0 111.2 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.5 pp -72.96 -23.52 60.67 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -173.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -79.02 157.82 28.01 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.21 1.004 . . . . 0.0 112.814 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.2 133.41 52.8 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.614 0.766 . . . . 0.0 112.265 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 70.1 mt -88.81 159.38 17.77 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.879 1.272 . . . . 0.0 112.458 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -147.73 145.13 28.73 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.79 1.636 . . . . 0.0 111.008 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -69.28 157.02 37.8 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.163 0.985 . . . . 0.0 112.761 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 86.8 mt -71.16 143.52 50.5 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.694 1.198 . . . . 0.0 112.223 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -72.98 -20.87 60.94 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 94.4 p -155.8 165.4 36.62 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.186 1.794 . . . . 0.0 111.181 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 94.6 mt -131.01 153.96 48.69 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.392 1.477 . . . . 0.0 111.779 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.0 m -74.04 -3.54 29.99 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.251 1.42 . . . . 0.0 114.798 -178.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -143.66 143.87 31.64 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.37 1.868 . . . . 0.0 111.027 -177.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 . . . . . 0 C--O 1.253 1.248 0 C-N-CA 126.279 1.832 . . . . 0.0 113.404 177.281 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt -66.64 141.23 96.84 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.186 0.995 . . . . 0.0 112.034 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -58.79 154.07 46.08 Favored 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.401 2.734 . . . . 0.0 114.185 175.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.18 158.33 55.27 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.56 2.84 . . . . 0.0 112.857 176.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -65.61 156.92 61.23 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.596 2.864 . . . . 0.0 113.053 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -150.78 175.01 12.4 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.881 1.672 . . . . 0.0 111.623 -177.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -75.86 55.51 0.89 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.43 1.492 . . . . 0.0 112.406 176.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.7 mt -133.18 136.89 54.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 126.329 1.852 . . . . 0.0 109.418 -172.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.4 m -132.51 131.87 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.988 1.315 . . . . 0.0 111.646 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.22 143.6 47.07 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.738 0.815 . . . . 0.0 110.635 172.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 26.8 m -139.65 150.67 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.983 1.713 . . . . 0.0 110.988 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.37 109.54 19.23 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.558 1.143 . . . . 0.0 109.751 173.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.8 mt -99.8 124.59 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 123.848 0.859 . . . . 0.0 109.988 -173.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -93.29 149.37 21.28 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.254 1.422 . . . . 0.0 112.612 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.8 t-105 -153.18 142.89 15.04 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.957 1.703 . . . . 0.0 110.276 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -59.99 138.9 85.01 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.698 2.265 . . . . 0.0 113.77 -175.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.85 12.8 75.08 Favored Glycine 0 CA--C 1.539 1.584 0 N-CA-C 115.436 0.934 . . . . 0.0 115.436 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.41 156.84 47.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.195 1.398 . . . . 0.0 112.912 -177.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -72.38 155.55 91.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 124.368 1.067 . . . . 0.0 111.15 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -65.89 129.26 21.61 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.554 2.169 . . . . 0.0 112.06 -177.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 tttp -79.42 106.05 11.17 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.321 1.448 . . . . 0.0 109.853 174.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.6 mt -75.38 126.89 31.92 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.338 0.655 . . . . 0.0 109.453 169.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.0 ptm -153.13 177.76 10.47 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.213 1.005 . . . . 0.0 111.462 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -117.06 129.93 56.33 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.002 0.921 . . . . 0.0 112.023 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.0 mt -92.39 109.28 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.343 1.457 . . . . 0.0 108.462 170.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -83.98 119.56 25.06 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -66.65 -11.18 52.75 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -176.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -86.76 -23.56 25.4 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.011 1.324 . . . . 0.0 113.856 171.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -78.56 141.31 60.5 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.454 1.024 . . . . 0.0 111.372 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.71 144.28 59.27 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.278 2.652 . . . . 0.0 111.628 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.71 -31.01 71.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.377 -0.82 . . . . 0.0 112.762 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.3 t -59.18 -46.83 87.39 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.874 1.215 . . . . 0.0 111.98 174.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.6 -39.64 91.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.589 -0.694 . . . . 0.0 112.329 176.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -63.81 -48.67 85.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.491 0.716 . . . . 0.0 110.513 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.2 mt -62.7 -37.1 78.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.71 1.204 . . . . 0.0 110.977 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.53 -39.72 84.86 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.545 0.738 . . . . 0.0 112.038 170.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -73.26 -24.73 60.49 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.711 1.204 . . . . 0.0 113.762 173.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 32.3 t -69.31 -61.23 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.644 1.111 . . . . 0.0 110.587 169.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 29.8 p -64.08 -34.32 77.77 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.797 0.839 . . . . 0.0 112.624 -170.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.71 -29.24 69.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.879 0.872 . . . . 0.0 112.906 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.79 -23.54 67.4 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.406 1.003 . . . . 0.0 114.171 174.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -115.0 11.53 16.51 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.974 1.71 . . . . 0.0 113.288 172.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.0 t 55.65 29.34 13.48 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.088 1.755 . . . . 0.0 114.282 -176.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.0 mt -79.1 131.23 36.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.22 1.408 . . . . 0.0 110.705 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.89 164.43 22.64 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.697 1.199 . . . . 0.0 113.623 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 53.14 68.87 0.77 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.403 1.881 . . . . 0.0 113.749 170.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -62.65 -21.01 65.37 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.229 -0.92 . . . . 0.0 113.068 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -54.78 -31.01 58.25 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.737 1.615 . . . . 0.0 113.117 171.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 -77.12 -21.0 54.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.791 0.837 . . . . 0.0 112.68 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -94.71 158.96 15.28 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 122.731 1.253 . . . . 0.0 114.002 -169.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.9 154.07 39.91 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.058 2.543 . . . . 0.0 109.585 174.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 34.1 mt -86.4 154.05 21.47 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 167.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -144.92 145.76 31.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.354 1.061 . . . . 0.0 110.561 178.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -63.74 132.1 49.93 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 122.014 -0.429 . . . . 0.0 111.755 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -108.45 -28.84 9.13 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.842 0.857 . . . . 0.0 113.162 176.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -69.25 -36.99 77.71 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 41.6 t -160.93 151.49 18.13 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.778 1.231 . . . . 0.0 112.676 -178.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.8 m 59.75 -17.29 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 118.983 2.957 . . . . 0.0 118.983 169.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.0 m120 57.04 34.86 25.59 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.94 1.696 . . . . 0.0 115.172 173.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -67.07 136.76 55.7 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.219 -0.926 . . . . 0.0 110.733 169.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -71.67 145.11 49.1 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.085 0.554 . . . . 0.0 110.436 169.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.6 mm -83.6 135.05 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 C-N-CA 123.847 0.859 . . . . 0.0 110.52 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.6 p -145.52 168.0 21.65 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.815 2.046 . . . . 0.0 109.119 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -62.0 -16.72 53.65 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 121.123 -0.985 . . . . 0.0 113.171 175.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -88.33 -34.56 17.59 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.664 1.586 . . . . 0.0 113.529 170.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -92.84 -25.43 18.11 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -57.27 -25.17 58.78 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -171.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -67.87 -15.3 63.56 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.354 1.062 . . . . 0.0 113.51 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -78.87 -16.19 57.37 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.5 mt -67.08 139.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.743 1.217 . . . . 0.0 110.09 175.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -126.79 161.63 27.74 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.405 1.482 . . . . 0.0 111.703 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -61.66 119.61 9.01 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.894 -0.504 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.47 10.71 60.29 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 125.333 1.444 . . . . 0.0 115.625 -174.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.9 m -63.66 132.44 51.09 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.615 1.707 . . . . 0.0 111.709 178.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.3 mt -86.62 125.33 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.566 0.747 . . . . 0.0 109.388 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -122.29 172.37 8.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.329 1.852 . . . . 0.0 111.156 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtm105 -131.09 143.73 50.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.531 1.932 . . . . 0.0 110.584 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.36 136.63 34.28 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 166.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.0 t -157.24 151.95 25.54 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.728 0.811 . . . . 0.0 111.044 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.8 p -72.23 136.66 46.43 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.674 -1.266 . . . . 0.0 110.846 171.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 31.4 t -63.39 145.51 97.06 Favored Pre-proline 0 CA--C 1.542 0.654 0 C-N-CA 125.516 1.527 . . . . 0.0 113.164 -173.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -63.56 -11.85 28.18 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.212 2.608 . . . . 0.0 113.525 171.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.88 -12.53 61.31 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 172.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -64.39 149.61 48.01 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.107 0.867 . . . . 0.0 112.615 177.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -69.15 157.36 37.04 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.729 1.212 . . . . 0.0 113.908 -173.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -145.91 157.95 43.88 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.033 1.733 . . . . 0.0 111.941 177.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -70.47 160.45 32.37 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -177.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -76.41 160.01 29.94 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.458 1.103 . . . . 0.0 111.495 168.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.2 mt -76.18 147.91 38.11 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.287 1.035 . . . . 0.0 112.277 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -86.83 8.1 24.29 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -68.95 159.28 33.0 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.67 1.188 . . . . 0.0 114.113 -175.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -143.01 142.39 31.58 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.502 1.921 . . . . 0.0 110.987 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 93.8 mt -72.18 110.94 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 169.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -83.64 -23.43 31.81 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 8.0 t -81.74 -178.5 7.0 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.425 1.49 . . . . 0.0 112.796 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 47.8 t -62.8 158.02 19.83 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.995 1.318 . . . . 0.0 112.485 171.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 65.2 m -71.55 -14.26 62.04 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 177.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.2 ptm -68.08 159.95 29.87 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.179 0.992 . . . . 0.0 112.927 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 52.3 p30 -145.73 179.09 7.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.117 1.367 . . . . 0.0 112.077 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.06 -3.3 31.74 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -173.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.65 144.23 55.62 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.46 1.104 . . . . 0.0 112.138 -177.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.6 mt -68.51 154.78 41.19 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.383 1.073 . . . . 0.0 112.513 178.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -77.68 47.82 0.64 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.742 1.617 . . . . 0.0 113.234 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.74 148.13 52.33 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.637 1.175 . . . . 0.0 112.514 177.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.9 mt -137.87 154.66 49.45 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.881 1.673 . . . . 0.0 111.655 -177.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -152.25 143.28 23.1 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.886 1.674 . . . . 0.0 110.915 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -84.86 106.86 16.7 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.867 0.867 . . . . 0.0 110.803 171.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 11.1 mp -83.15 -11.09 58.25 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.383 1.073 . . . . 0.0 113.593 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.65 136.49 57.03 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.049 0.94 . . . . 0.0 112.613 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.3 p -81.14 -24.66 37.47 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.633 1.173 . . . . 0.0 114.063 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.9 pp -72.16 153.72 41.47 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.585 1.154 . . . . 0.0 113.074 -178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 90.7 p -137.76 3.65 2.5 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.194 1.398 . . . . 0.0 114.206 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -70.1 163.07 27.02 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.308 1.443 . . . . 0.0 113.918 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.333 1.453 . . . . 0.0 112.831 169.571 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.59 0 N-CA-C 111.834 -0.506 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ptp -67.57 158.24 83.28 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 124.0 0.92 . . . . 0.0 112.82 177.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.97 156.79 42.1 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.264 2.643 . . . . 0.0 114.132 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -61.5 163.89 16.86 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 123.595 2.863 . . . . 0.0 114.145 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -57.43 156.26 26.96 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.91 3.073 . . . . 0.0 113.873 172.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.37 142.64 58.31 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 47.8 p30 -142.64 19.28 2.02 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.111 1.764 . . . . 0.0 113.19 -174.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.5 mt -125.94 137.55 57.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.072 1.749 . . . . 0.0 109.619 178.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -130.9 133.51 62.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.114 1.366 . . . . 0.0 112.209 -178.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -71.29 141.71 50.5 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.187 0.995 . . . . 0.0 111.518 171.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -141.28 153.05 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.46 1.504 . . . . 0.0 111.838 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.68 116.52 28.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.945 1.298 . . . . 0.0 109.966 173.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.9 mt -107.41 120.75 59.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.162 0.985 . . . . 0.0 110.607 -170.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -81.16 149.08 29.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.217 1.407 . . . . 0.0 112.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -152.53 142.88 15.26 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.798 1.639 . . . . 0.0 109.97 169.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -62.14 136.47 60.7 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.512 2.141 . . . . 0.0 113.416 -172.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.09 12.53 71.92 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 115.214 0.845 . . . . 0.0 115.214 -179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.41 154.32 50.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.098 1.359 . . . . 0.0 112.892 -177.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -68.83 153.8 95.56 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 124.433 1.093 . . . . 0.0 111.633 172.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -66.07 125.6 14.39 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.62 2.213 . . . . 0.0 111.68 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -77.74 110.64 12.77 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 110.415 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -75.94 127.09 32.26 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.294 0.638 . . . . 0.0 109.86 169.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 21.9 ptm -151.72 -178.0 6.45 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.259 1.024 . . . . 0.0 111.837 173.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -120.5 132.6 55.27 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.421 1.088 . . . . 0.0 112.117 176.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.3 mt -96.72 111.87 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.416 1.486 . . . . 0.0 108.836 171.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -81.69 115.44 20.95 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -67.23 -10.77 53.97 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -175.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -90.16 -22.55 21.67 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.743 1.217 . . . . 0.0 113.866 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -87.37 145.56 37.89 Favored Pre-proline 0 N--CA 1.482 1.152 0 CA-C-N 119.667 1.122 . . . . 0.0 111.336 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.36 146.42 56.4 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.272 2.648 . . . . 0.0 112.74 -173.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.88 -31.6 71.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.343 0.657 . . . . 0.0 112.533 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.3 m -60.27 -42.2 94.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.24 0.927 . . . . 0.0 112.471 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.19 -40.07 78.3 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.194 0.598 . . . . 0.0 111.914 175.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.52 -49.05 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 123.288 0.635 . . . . 0.0 110.751 174.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 56.4 mt -61.35 -37.54 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.04 0.936 . . . . 0.0 111.146 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -59.33 -45.98 89.86 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.031 0.832 . . . . 0.0 111.974 170.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -68.89 -26.11 64.94 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.831 1.252 . . . . 0.0 113.094 177.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 67.1 t -68.01 -60.83 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 119.185 0.902 . . . . 0.0 109.505 168.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.2 m -58.02 -36.54 72.86 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.34 1.456 . . . . 0.0 113.381 -170.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -59.18 -27.9 66.12 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.194 0.998 . . . . 0.0 113.526 177.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.01 -27.28 73.24 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.326 -0.859 . . . . 0.0 114.205 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -106.48 13.81 27.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.454 1.502 . . . . 0.0 112.756 173.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.2 m 55.56 27.46 10.42 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.128 1.771 . . . . 0.0 114.211 -177.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.2 mt -75.9 114.31 14.38 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.64 1.176 . . . . 0.0 110.909 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.75 162.0 30.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.357 1.063 . . . . 0.0 112.049 173.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 54.37 55.69 7.8 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.403 1.481 . . . . 0.0 113.332 176.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -57.76 -17.74 17.41 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 113.368 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -56.37 -28.58 59.62 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.11 1.364 . . . . 0.0 112.966 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -78.32 -14.86 59.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.158 0.983 . . . . 0.0 112.73 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -94.42 157.75 15.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.56 1.144 . . . . 0.0 114.054 -169.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.51 145.65 31.14 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.13 2.172 . . . . 0.0 109.715 176.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -79.95 145.32 32.67 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.532 0.682 . . . . 0.0 109.593 168.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -134.06 146.85 50.71 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.371 1.869 . . . . 0.0 108.83 -176.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -72.69 146.45 46.49 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.466 -0.771 . . . . 0.0 112.578 176.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -129.21 -27.57 2.45 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.61 1.164 . . . . 0.0 112.325 169.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -72.86 -51.11 20.04 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.087 0.955 . . . . 0.0 111.513 169.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.9 t -85.59 -177.11 6.33 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.557 1.143 . . . . 0.0 112.354 171.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 t -63.66 170.05 3.55 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.263 1.025 . . . . 0.0 111.745 169.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -70.01 42.11 0.05 Allowed 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 127.189 2.196 . . . . 0.0 116.599 -168.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -74.4 112.85 10.98 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.877 1.271 . . . . 0.0 111.512 171.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -61.47 136.57 58.07 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.842 -0.536 . . . . 0.0 110.421 169.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.7 mm -75.11 130.11 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 123.438 0.695 . . . . 0.0 110.333 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.0 p -140.22 164.12 30.92 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.888 1.675 . . . . 0.0 110.845 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -60.6 -15.3 26.64 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.218 -0.926 . . . . 0.0 113.056 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -89.26 -15.03 34.52 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.078 1.751 . . . . 0.0 114.671 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -135.41 -7.21 2.25 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -174.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -57.16 -21.22 31.28 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -61.22 -21.58 63.98 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.914 1.286 . . . . 0.0 113.173 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.18 -13.97 60.5 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.01 0.924 . . . . 0.0 113.201 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 80.4 mt -71.32 131.94 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 124.334 1.054 . . . . 0.0 109.778 174.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -116.23 170.37 8.58 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.812 1.645 . . . . 0.0 112.507 171.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -58.79 128.58 37.92 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.912 -0.493 . . . . 0.0 111.013 169.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.1 9.46 76.84 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 124.961 1.267 . . . . 0.0 115.251 -176.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.7 m -64.96 130.19 42.48 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.546 1.673 . . . . 0.0 111.326 177.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.5 mt -85.6 124.48 40.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 123.436 0.694 . . . . 0.0 109.321 170.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -122.38 177.79 5.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.991 2.116 . . . . 0.0 110.28 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -144.53 136.73 26.26 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.75 2.02 . . . . 0.0 110.019 178.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.0 tp -82.32 137.44 34.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.341 0.656 . . . . 0.0 109.999 169.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 11.5 t -157.26 159.45 37.62 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.168 0.987 . . . . 0.0 110.555 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.2 p -72.08 144.69 48.6 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.72 -1.238 . . . . 0.0 110.548 169.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.6 t -56.7 149.06 43.66 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 125.729 1.612 . . . . 0.0 113.029 -174.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -65.57 -17.86 58.02 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 122.896 2.397 . . . . 0.0 113.136 173.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -105.58 -54.71 2.44 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.933 1.293 . . . . 0.0 112.92 177.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 56.52 -62.72 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 128.208 2.603 . . . . 0.0 115.623 -170.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 -83.68 150.36 25.91 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.688 1.595 . . . . 0.0 112.801 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.2 141.02 49.03 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.796 0.838 . . . . 0.0 112.506 178.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -155.64 151.05 27.0 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.563 1.545 . . . . 0.0 111.481 176.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -91.38 -33.16 15.38 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.175 1.39 . . . . 0.0 112.338 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mp -77.97 147.97 34.66 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.285 1.434 . . . . 0.0 112.292 -174.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -155.32 159.58 40.08 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.341 1.856 . . . . 0.0 110.846 174.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -157.5 169.42 24.74 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.745 1.218 . . . . 0.0 112.536 -176.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 23.2 tpp85 -61.41 143.34 56.0 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.862 1.265 . . . . 0.0 111.52 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -56.14 135.11 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.923 1.289 . . . . 0.0 111.269 -177.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -130.8 176.49 8.16 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.49 1.916 . . . . 0.0 112.465 -171.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 19.6 m -59.32 155.71 14.03 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.19 1.396 . . . . 0.0 113.281 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.2 m -73.82 43.19 0.15 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.604 1.962 . . . . 0.0 115.532 -171.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.6 t -66.46 148.11 52.34 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.622 1.169 . . . . 0.0 111.826 172.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 61.1 mtt -142.42 152.99 43.35 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.312 1.445 . . . . 0.0 112.251 -175.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -80.02 -1.41 39.64 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.755 1.222 . . . . 0.0 114.134 178.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 58.64 22.56 10.0 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.422 1.889 . . . . 0.0 114.805 -174.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -152.64 165.99 33.52 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.008 2.123 . . . . 0.0 111.556 177.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.3 tp -146.68 127.82 14.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.835 1.254 . . . . 0.0 110.657 172.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -144.36 142.64 30.51 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.628 1.571 . . . . 0.0 110.664 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -82.78 131.51 35.2 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.675 0.79 . . . . 0.0 111.544 173.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.0 pp -154.66 160.48 41.44 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.191 1.396 . . . . 0.0 112.302 176.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -132.44 158.09 42.92 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.793 1.637 . . . . 0.0 111.575 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -152.68 -57.09 0.13 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.294 1.438 . . . . 0.0 110.456 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 28.8 tp 62.5 -14.89 0.06 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 128.636 2.775 . . . . 0.0 116.706 170.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.84 143.01 55.61 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.706 1.202 . . . . 0.0 112.53 175.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 84.1 p -157.06 167.2 31.14 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.234 1.414 . . . . 0.0 111.986 -176.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.16 133.86 56.49 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.914 1.286 . . . . 0.0 112.0 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 67.1 m -67.85 148.41 51.21 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.026 0.93 . . . . 0.0 113.118 -178.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -69.73 171.31 9.32 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.935 1.294 . . . . 0.0 113.509 173.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 43.3 t0 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 126.191 1.796 . . . . 0.0 110.844 169.142 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.562 0 N-CA-C 111.972 -0.451 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.29 149.79 97.34 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.173 0.989 . . . . 0.0 112.715 178.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -67.77 159.69 51.62 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 C-N-CA 123.648 2.899 . . . . 0.0 112.911 176.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -65.24 155.37 68.87 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 123.498 2.798 . . . . 0.0 112.58 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -68.26 149.02 75.54 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 123.514 2.809 . . . . 0.0 113.113 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.87 71.12 3.38 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.187 1.395 . . . . 0.0 112.138 178.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.53 67.22 1.48 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.787 1.635 . . . . 0.0 111.205 174.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 26.2 mt -108.39 137.71 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.946 1.698 . . . . 0.0 110.454 -177.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.1 m -132.08 134.29 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.656 1.583 . . . . 0.0 111.413 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.1 143.03 35.93 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.02 0.928 . . . . 0.0 110.992 174.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.93 157.6 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.737 1.615 . . . . 0.0 111.459 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.21 115.91 26.85 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.637 1.175 . . . . 0.0 110.033 172.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.1 mt -104.65 125.16 59.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 123.833 0.853 . . . . 0.0 110.333 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -89.16 144.34 26.19 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.887 1.275 . . . . 0.0 112.316 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -153.79 143.99 15.59 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.104 1.762 . . . . 0.0 110.068 173.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -62.79 145.06 94.7 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.724 2.283 . . . . 0.0 113.985 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 11.34 75.08 Favored Glycine 0 CA--C 1.539 1.552 0 N-CA-C 115.484 0.954 . . . . 0.0 115.484 178.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -143.7 156.82 44.66 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.215 1.406 . . . . 0.0 112.64 -177.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -69.55 153.77 95.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 123.767 0.827 . . . . 0.0 111.314 169.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.74 128.98 28.76 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.516 2.144 . . . . 0.0 112.907 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -81.0 112.08 18.07 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.91 1.284 . . . . 0.0 110.365 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.4 mt -76.64 127.5 32.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.455 0.702 . . . . 0.0 109.62 169.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -153.89 171.6 18.72 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.171 0.988 . . . . 0.0 111.538 177.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -114.85 124.54 52.0 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.796 0.838 . . . . 0.0 112.82 178.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.0 mt -91.6 110.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 125.705 1.602 . . . . 0.0 108.5 174.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -85.48 117.07 24.17 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 123.779 0.832 . . . . 0.0 109.259 169.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -67.23 -13.32 61.86 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -84.26 -23.14 30.51 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.613 1.165 . . . . 0.0 113.45 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -79.94 148.03 67.38 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 124.569 1.148 . . . . 0.0 111.926 177.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.58 141.25 49.78 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.748 2.299 . . . . 0.0 111.041 175.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.38 -31.63 70.53 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.002 0.521 . . . . 0.0 112.004 177.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -59.82 -42.64 93.96 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.211 0.914 . . . . 0.0 112.804 175.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.34 79.74 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.823 -0.548 . . . . 0.0 111.99 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.57 -48.18 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.669 0.787 . . . . 0.0 110.523 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -62.68 -35.76 72.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 124.075 0.95 . . . . 0.0 110.757 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -60.13 -44.09 95.18 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.401 1.001 . . . . 0.0 112.28 170.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -67.48 -34.02 76.31 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.421 1.088 . . . . 0.0 112.932 177.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.88 -53.17 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.917 0.887 . . . . 0.0 111.119 172.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 86.6 m -59.87 -42.57 94.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.819 0.848 . . . . 0.0 112.076 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.47 -27.89 68.89 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.641 0.776 . . . . 0.0 112.971 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -62.8 -23.64 65.67 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.457 1.027 . . . . 0.0 114.289 172.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -115.23 16.61 16.87 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.02 1.728 . . . . 0.0 113.161 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.8 m 56.29 25.14 9.0 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 126.049 1.739 . . . . 0.0 114.732 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 74.4 mt -75.13 122.89 24.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.236 1.414 . . . . 0.0 111.712 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.08 163.36 27.66 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.145 . . . . 0.0 112.168 171.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 53.06 52.95 12.77 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.454 1.501 . . . . 0.0 113.181 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -57.73 -24.76 58.53 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.146 0.979 . . . . 0.0 112.811 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -63.48 -12.71 33.96 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.321 1.448 . . . . 0.0 113.937 173.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -81.56 -17.45 48.36 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.309 -0.87 . . . . 0.0 112.739 168.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -94.98 160.96 14.34 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 122.637 1.208 . . . . 0.0 113.951 -169.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.66 152.51 42.51 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.721 2.409 . . . . 0.0 109.479 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.0 mt -82.81 155.59 24.11 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -143.4 144.03 31.88 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.442 1.097 . . . . 0.0 110.614 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -67.47 134.1 50.74 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 176.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -105.49 -32.02 8.72 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.104 0.962 . . . . 0.0 111.591 167.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -75.26 -49.17 20.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.078 0.951 . . . . 0.0 113.054 172.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -82.62 177.38 8.73 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.719 0.807 . . . . 0.0 112.12 173.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.3 t -74.95 59.42 0.91 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.155 1.782 . . . . 0.0 114.759 -169.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 59.12 21.26 9.24 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.604 1.962 . . . . 0.0 115.753 171.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -67.24 133.54 49.92 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.738 -1.227 . . . . 0.0 111.905 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -69.83 143.08 52.99 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.11 0.564 . . . . 0.0 110.056 169.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.4 mm -82.65 132.52 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.625 0.77 . . . . 0.0 110.725 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.0 p -148.9 172.3 14.91 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.244 2.217 . . . . 0.0 109.275 -174.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -59.58 -20.74 57.89 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 120.802 -1.186 . . . . 0.0 113.325 172.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.22 -18.8 23.83 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.528 1.531 . . . . 0.0 113.72 175.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -114.87 -19.27 11.06 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -174.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -61.14 -23.12 65.3 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.528 1.306 . . . . 0.0 114.528 -175.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -63.94 -22.83 67.1 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.949 1.3 . . . . 0.0 113.184 173.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -75.26 -13.6 60.45 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 112.864 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.1 mt -74.14 128.66 36.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.4 1.08 . . . . 0.0 109.514 172.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -113.5 173.67 6.29 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.415 1.486 . . . . 0.0 111.946 169.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -61.69 130.88 47.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.692 -0.63 . . . . 0.0 111.14 170.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.14 9.98 83.28 Favored Glycine 0 CA--C 1.539 1.548 0 C-N-CA 125.143 1.354 . . . . 0.0 115.646 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 88.7 m -65.95 131.74 46.96 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 119.637 1.719 . . . . 0.0 111.736 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 51.1 mt -85.34 127.73 39.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 C-N-CA 123.574 0.75 . . . . 0.0 109.351 169.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.4 mt -124.05 171.78 9.49 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.841 2.056 . . . . 0.0 110.855 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -133.38 136.2 45.16 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 127.077 2.151 . . . . 0.0 110.229 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -82.27 137.57 34.81 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 168.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 6.8 t -156.76 150.09 24.25 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.776 0.83 . . . . 0.0 111.44 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.6 p -70.54 127.51 32.96 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.748 -1.22 . . . . 0.0 110.287 170.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.2 t -66.81 141.11 96.6 Favored Pre-proline 0 CA--C 1.537 0.46 0 C-N-CA 125.197 1.399 . . . . 0.0 112.703 -172.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -62.3 -25.96 76.88 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.416 2.077 . . . . 0.0 112.024 170.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -78.13 -11.92 59.95 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 176.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -14.1 62.4 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 120.29 1.404 . . . . 0.0 113.7 -178.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -64.9 -21.95 66.91 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.849 1.26 . . . . 0.0 112.907 170.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -98.93 5.64 47.15 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.728 1.611 . . . . 0.0 114.314 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -63.54 152.05 39.72 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.234 0.925 . . . . 0.0 112.874 177.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -136.81 165.24 26.4 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.912 1.685 . . . . 0.0 111.583 -176.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.1 mt -65.95 131.07 45.38 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.777 0.831 . . . . 0.0 111.856 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -158.55 165.2 35.09 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.931 1.692 . . . . 0.0 111.884 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -77.61 138.76 39.3 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.582 0.753 . . . . 0.0 112.558 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.41 138.51 41.74 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.567 1.147 . . . . 0.0 110.395 170.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -67.32 -49.8 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.763 0.825 . . . . 0.0 110.668 176.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -155.85 133.73 11.24 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.523 1.529 . . . . 0.0 110.44 171.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 39.2 m -80.92 -37.06 30.23 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.747 1.219 . . . . 0.0 113.285 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 33.8 t -160.58 155.32 23.98 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.107 1.363 . . . . 0.0 112.065 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 80.9 p -74.85 -20.33 59.8 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.38 1.072 . . . . 0.0 113.523 171.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 62.1 mtt -145.48 144.25 30.48 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.41 1.484 . . . . 0.0 112.201 -177.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -84.39 29.02 0.61 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.103 1.361 . . . . 0.0 113.361 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.81 141.77 51.34 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.721 1.209 . . . . 0.0 112.681 -177.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -78.06 140.65 39.12 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.355 1.062 . . . . 0.0 111.961 177.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.8 tp -78.59 150.19 32.8 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.752 1.221 . . . . 0.0 111.523 172.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -146.22 162.8 37.26 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.304 1.442 . . . . 0.0 111.765 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -147.79 161.26 41.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.21 1.404 . . . . 0.0 112.024 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 88.9 mt -73.13 -16.39 61.45 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -177.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.19 160.86 43.6 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.238 1.815 . . . . 0.0 112.406 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -76.2 157.87 32.24 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.424 1.09 . . . . 0.0 112.609 176.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.1 pp -69.78 -1.81 10.29 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -76.42 22.15 0.17 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.338 1.855 . . . . 0.0 114.975 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.0 m -63.41 -1.99 1.36 Allowed 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -172.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.43 -14.71 63.04 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.878 1.271 . . . . 0.0 113.195 169.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.4 p -65.73 158.57 27.19 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.721 1.208 . . . . 0.0 113.331 175.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -150.87 146.9 26.63 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.714 1.605 . . . . 0.0 111.342 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 125.226 1.41 . . . . 0.0 113.639 178.152 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.389 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptp -73.19 163.03 71.53 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 124.136 0.974 . . . . 0.0 112.304 176.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -57.74 149.03 71.16 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 123.238 2.625 . . . . 0.0 113.002 173.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.65 149.68 83.89 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.166 2.577 . . . . 0.0 113.256 -173.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -67.0 160.45 47.19 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.676 2.917 . . . . 0.0 111.19 171.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -152.19 153.82 34.58 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -172.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 50.51 31.34 5.47 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.338 1.855 . . . . 0.0 113.738 173.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.9 mt -60.21 133.3 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 125.197 1.399 . . . . 0.0 111.097 -174.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.9 m -134.22 131.3 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.005 1.322 . . . . 0.0 112.609 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -67.52 141.5 56.87 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.167 0.987 . . . . 0.0 110.952 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.1 m -142.03 153.55 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.797 1.239 . . . . 0.0 112.062 175.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -115.06 120.55 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.921 1.288 . . . . 0.0 109.602 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.0 mt -107.92 122.21 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.645 0.778 . . . . 0.0 110.593 -171.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -84.9 149.67 25.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.981 1.712 . . . . 0.0 113.187 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -156.74 142.2 12.58 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.038 1.735 . . . . 0.0 110.27 169.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -60.59 137.45 73.65 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.642 2.228 . . . . 0.0 113.506 -176.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.87 12.56 74.94 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.28 154.13 51.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.252 1.421 . . . . 0.0 112.61 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -72.07 152.82 92.75 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.659 0.784 . . . . 0.0 111.435 169.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -61.43 131.73 37.53 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.581 2.188 . . . . 0.0 113.063 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -82.77 109.05 16.58 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.105 0.962 . . . . 0.0 110.023 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.6 mt -74.83 132.04 41.23 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.41 0.684 . . . . 0.0 110.081 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.8 ptp -154.02 179.97 8.43 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.218 1.007 . . . . 0.0 111.964 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -123.41 125.38 44.85 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.729 1.211 . . . . 0.0 111.338 171.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.6 mt -86.79 110.96 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 124.629 1.172 . . . . 0.0 108.891 172.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -82.99 121.59 27.2 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.152 0.981 . . . . 0.0 108.462 167.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -69.8 -10.38 58.19 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -86.38 -15.18 41.22 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.473 1.286 . . . . 0.0 114.473 169.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -87.79 140.72 31.39 Favored Pre-proline 0 N--CA 1.479 0.994 0 CA-C-N 120.071 1.305 . . . . 0.0 111.142 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -68.03 144.09 62.51 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 123.315 2.676 . . . . 0.0 111.443 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.0 mt -59.68 -33.4 71.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.94 177.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m -58.57 -43.75 89.53 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.26 0.936 . . . . 0.0 112.637 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.73 -38.94 77.03 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.95 0.5 . . . . 0.0 112.147 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.87 -47.27 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.476 0.71 . . . . 0.0 110.422 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.1 mt -62.52 -36.24 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.903 1.281 . . . . 0.0 111.144 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -61.86 -39.55 92.27 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.954 0.797 . . . . 0.0 112.385 170.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -70.01 -27.09 64.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.987 0.915 . . . . 0.0 113.278 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 34.7 t -69.39 -57.37 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 119.58 1.082 . . . . 0.0 110.82 169.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.5 p -63.96 -34.41 77.91 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.499 0.72 . . . . 0.0 112.557 -169.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.99 -27.61 68.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.31 1.044 . . . . 0.0 113.064 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.53 -22.98 70.12 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.305 0.955 . . . . 0.0 114.045 174.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -120.57 13.79 11.76 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.136 1.774 . . . . 0.0 113.106 176.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.4 m 55.77 29.22 13.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.249 1.82 . . . . 0.0 114.515 -178.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.91 128.2 33.17 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.659 1.183 . . . . 0.0 110.403 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.49 165.7 20.98 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.744 1.218 . . . . 0.0 113.35 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 53.87 63.1 2.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.121 1.769 . . . . 0.0 113.746 170.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -60.39 -19.98 57.91 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.612 0.968 . . . . 0.0 113.612 -177.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -57.32 -26.23 60.59 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.24 1.416 . . . . 0.0 113.193 171.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -81.37 -19.6 42.34 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.989 0.916 . . . . 0.0 112.782 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -92.09 157.88 16.51 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.583 1.182 . . . . 0.0 113.943 -169.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.32 154.38 41.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.014 2.526 . . . . 0.0 109.736 175.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.9 mt -89.69 151.19 21.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 167.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -142.05 147.0 36.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.636 1.174 . . . . 0.0 110.137 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 -65.18 143.21 58.0 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.36 -25.38 1.74 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.03 1.332 . . . . 0.0 113.308 174.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -73.21 -9.61 58.89 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.389 1.076 . . . . 0.0 112.97 168.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.5 t -144.47 -171.38 3.58 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.431 2.292 . . . . 0.0 109.961 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.7 m -54.79 153.03 6.48 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.397 1.079 . . . . 0.0 112.173 173.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -71.0 48.83 0.12 Allowed 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 126.963 2.105 . . . . 0.0 115.657 -169.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -70.98 132.94 45.94 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.318 -1.489 . . . . 0.0 111.508 171.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -74.63 141.12 44.67 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.308 0.643 . . . . 0.0 111.305 171.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 35.0 mm -80.3 132.81 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.37 1.068 . . . . 0.0 110.339 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 19.5 p -140.42 163.67 32.19 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.746 1.618 . . . . 0.0 111.023 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -61.27 -12.64 14.16 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.088 -1.008 . . . . 0.0 113.197 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -94.62 -15.24 24.18 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.156 1.782 . . . . 0.0 114.472 176.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -132.93 -7.73 3.09 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 -176.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -54.95 -22.73 16.02 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -64.87 -18.26 65.01 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.569 1.548 . . . . 0.0 113.556 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -78.98 -14.54 59.15 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.097 0.959 . . . . 0.0 113.579 176.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 83.5 mt -65.51 141.79 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 124.944 1.298 . . . . 0.0 110.101 174.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -127.4 160.87 30.1 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.212 1.405 . . . . 0.0 111.723 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -60.08 124.46 20.29 Favored 'General case' 0 CA--C 1.545 0.786 0 O-C-N 121.806 -0.559 . . . . 0.0 111.326 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.08 9.04 68.11 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.168 1.366 . . . . 0.0 115.174 -174.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 96.2 m -65.03 129.06 38.33 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.581 1.69 . . . . 0.0 111.105 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.0 mt -83.46 123.19 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 169.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -116.26 176.19 5.21 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.712 2.005 . . . . 0.0 110.161 174.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 33.5 ttp85 -143.94 135.94 26.44 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 126.367 1.867 . . . . 0.0 110.158 177.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 tp -77.64 140.53 39.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.844 0.858 . . . . 0.0 110.604 172.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.9 t -159.27 152.41 22.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.076 0.95 . . . . 0.0 111.425 -176.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 p -75.55 134.2 40.79 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.502 -1.374 . . . . 0.0 110.69 169.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 40.1 t -64.77 149.39 96.11 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.336 1.454 . . . . 0.0 113.625 -172.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -65.08 -15.29 49.69 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.994 2.463 . . . . 0.0 113.704 167.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -119.6 29.6 7.51 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.119 1.768 . . . . 0.0 114.082 -169.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -50.01 -44.24 51.08 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.49 1.116 . . . . 0.0 113.902 -175.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -93.53 -28.45 16.06 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.262 1.425 . . . . 0.0 113.6 175.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.36 -23.08 43.62 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -174.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 -60.77 135.48 57.79 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.531 1.132 . . . . 0.0 112.352 178.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -81.22 162.2 23.67 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.55 0.74 . . . . 0.0 112.054 172.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.84 137.63 40.59 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.209 0.604 . . . . 0.0 109.418 168.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -162.57 169.81 19.62 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.902 1.681 . . . . 0.0 110.664 174.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -148.25 96.3 2.6 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.929 0.892 . . . . 0.0 110.296 169.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 21.1 ttt85 -151.66 139.14 19.53 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.319 1.448 . . . . 0.0 111.632 -178.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.7 pt -107.02 -15.34 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.352 1.461 . . . . 0.0 114.495 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -160.53 159.62 30.91 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.073 1.349 . . . . 0.0 111.65 -172.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.3 p -68.22 -62.17 1.52 Allowed 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.658 -0.651 . . . . 0.0 110.614 169.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.7 t -162.03 144.58 11.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 126.518 1.927 . . . . 0.0 110.882 171.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.5 t -160.34 164.85 32.16 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.879 1.272 . . . . 0.0 112.0 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.2 ttt -144.71 129.96 18.67 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.753 1.621 . . . . 0.0 110.327 172.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -79.57 145.91 32.87 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -138.03 10.52 2.83 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.54 1.536 . . . . 0.0 113.314 175.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -70.47 129.07 38.27 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.18 1.392 . . . . 0.0 112.262 -178.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.1 tp -83.12 -31.91 26.98 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.461 1.104 . . . . 0.0 112.189 169.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -74.25 155.57 38.14 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.421 1.488 . . . . 0.0 112.829 175.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -153.56 169.2 23.8 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.598 1.559 . . . . 0.0 111.753 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.8 pp -143.31 170.23 16.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.474 1.509 . . . . 0.0 112.081 176.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -59.39 137.83 57.86 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.845 1.258 . . . . 0.0 112.549 -175.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.4 p-10 -141.86 -177.88 5.41 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.192 1.797 . . . . 0.0 112.081 -178.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 57.8 tp -144.34 142.96 30.73 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.758 1.623 . . . . 0.0 110.751 179.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -76.7 39.95 0.23 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.366 1.466 . . . . 0.0 113.795 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.3 p -84.91 -8.2 58.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.832 1.653 . . . . 0.0 114.798 -175.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 82.6 mt -66.11 151.47 46.84 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.581 1.153 . . . . 0.0 113.25 -176.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 23.9 t -65.95 137.94 57.49 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.459 0.704 . . . . 0.0 112.127 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? -78.92 152.13 31.31 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.119 1.368 . . . . 0.0 112.124 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.2 t0 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.925 1.69 . . . . 0.0 112.875 175.414 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.619 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.6 mtt -70.33 155.0 94.12 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.041 0.936 . . . . 0.0 112.607 177.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -59.58 155.2 43.53 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 123.595 2.864 . . . . 0.0 113.837 174.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -65.38 156.11 65.07 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 123.404 2.736 . . . . 0.0 112.381 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.82 146.04 76.88 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.403 2.735 . . . . 0.0 112.571 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -79.22 1.23 25.44 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.409 1.262 . . . . 0.0 114.409 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -79.07 51.25 1.13 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.534 1.934 . . . . 0.0 112.75 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.8 mt -133.75 134.54 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.028 1.731 . . . . 0.0 109.028 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.03 131.09 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.896 1.278 . . . . 0.0 112.03 -174.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -75.5 140.85 43.05 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.068 0.947 . . . . 0.0 110.568 172.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -140.79 155.56 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.54 1.536 . . . . 0.0 111.241 -178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.53 143.94 38.51 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.24 1.016 . . . . 0.0 109.638 168.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.9 mt -131.27 123.86 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 123.617 0.767 . . . . 0.0 110.481 -170.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -81.77 143.23 31.95 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.336 1.454 . . . . 0.0 112.703 174.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -155.61 142.55 13.56 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.75 1.62 . . . . 0.0 110.508 169.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -63.75 142.92 85.04 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.723 2.282 . . . . 0.0 113.63 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.18 13.45 70.19 Favored Glycine 0 CA--C 1.539 1.578 0 N-CA-C 115.346 0.898 . . . . 0.0 115.346 178.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -140.27 156.58 46.41 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.262 1.425 . . . . 0.0 112.587 -177.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -70.19 153.37 95.31 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.652 0.781 . . . . 0.0 111.267 169.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.11 128.13 25.45 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.663 2.242 . . . . 0.0 112.502 179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -83.33 123.36 29.56 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.814 0.846 . . . . 0.0 110.696 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 83.3 mt -85.79 135.59 33.67 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.529 0.732 . . . . 0.0 109.549 168.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -156.49 174.83 14.86 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.57 1.148 . . . . 0.0 111.486 174.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -120.2 118.34 30.24 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.245 1.018 . . . . 0.0 111.605 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.6 mt -83.69 111.28 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.241 1.417 . . . . 0.0 108.929 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -85.37 118.32 24.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.423 1.089 . . . . 0.0 109.629 169.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -68.56 -12.52 61.4 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -84.18 -23.65 30.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.515 1.126 . . . . 0.0 113.43 171.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -76.13 147.26 79.75 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 123.946 0.898 . . . . 0.0 111.929 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -67.84 144.14 63.83 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.974 2.45 . . . . 0.0 111.1 171.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.42 -32.08 72.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.994 -0.527 . . . . 0.0 112.173 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.6 m -58.4 -42.39 87.03 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.07 0.85 . . . . 0.0 112.555 174.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -41.61 71.93 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.897 -0.502 . . . . 0.0 111.958 175.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.09 -47.96 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.492 -0.755 . . . . 0.0 110.678 176.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 51.2 mt -59.82 -40.24 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 124.491 1.116 . . . . 0.0 110.671 177.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -58.99 -42.84 91.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.149 0.886 . . . . 0.0 112.514 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.59 -32.27 72.89 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.474 0.71 . . . . 0.0 112.469 178.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -68.57 -51.94 41.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 O-C-N 121.509 -0.744 . . . . 0.0 110.942 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 95.3 m -58.98 -44.1 91.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.785 0.834 . . . . 0.0 112.092 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -60.77 -29.38 69.39 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.218 1.007 . . . . 0.0 112.93 176.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.5 -23.52 66.87 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.241 0.924 . . . . 0.0 114.411 174.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -112.96 14.24 19.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.863 1.665 . . . . 0.0 113.261 171.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.3 m 55.33 25.96 8.13 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.914 1.686 . . . . 0.0 114.438 -175.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.3 mt -72.82 119.49 17.12 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.981 1.312 . . . . 0.0 110.813 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.47 165.03 25.88 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.388 1.075 . . . . 0.0 112.193 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.3 m120 55.23 53.87 9.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.326 1.45 . . . . 0.0 113.417 173.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -57.8 -17.57 16.67 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.244 1.018 . . . . 0.0 113.654 179.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -56.42 -20.46 19.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.835 1.654 . . . . 0.0 113.859 169.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -84.85 -15.92 43.06 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.639 1.576 . . . . 0.0 112.497 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -99.2 159.9 14.65 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.55 151.03 37.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.849 2.459 . . . . 0.0 109.81 171.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.3 mt -84.21 155.44 22.51 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 167.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -149.81 150.03 31.39 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.673 1.189 . . . . 0.0 110.044 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 -67.43 150.8 48.44 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.582 -0.698 . . . . 0.0 112.671 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -133.48 -6.19 2.92 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.722 1.209 . . . . 0.0 114.176 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -73.32 71.53 1.25 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.036 1.335 . . . . 0.0 111.755 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.2 m 62.63 -46.19 0.19 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 128.906 2.882 . . . . 0.0 115.558 -173.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.3 m -72.11 150.33 43.97 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.067 1.347 . . . . 0.0 111.604 169.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -130.08 37.11 3.94 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.539 1.535 . . . . 0.0 112.475 -178.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -65.69 134.41 53.16 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.169 -0.957 . . . . 0.0 110.911 171.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -67.86 144.29 55.36 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.965 -0.46 . . . . 0.0 110.354 169.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.9 mm -79.7 138.12 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.546 0.738 . . . . 0.0 110.715 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.4 p -146.3 173.37 12.31 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.492 2.317 . . . . 0.0 109.223 -175.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -58.47 -21.27 50.93 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 174.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -90.12 -45.65 8.99 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.775 1.23 . . . . 0.0 112.599 170.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -78.11 -21.16 50.82 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.994 0.918 . . . . 0.0 113.286 -171.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -57.81 -26.17 61.6 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.205 1.002 . . . . 0.0 113.676 173.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -74.0 -17.28 61.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.695 1.198 . . . . 0.0 113.071 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -79.4 -14.42 58.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.188 0.995 . . . . 0.0 112.831 173.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.3 mt -71.33 132.01 33.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.397 1.079 . . . . 0.0 109.641 174.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -122.88 165.24 16.99 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.903 1.681 . . . . 0.0 111.568 173.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -60.12 121.8 12.81 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 121.721 -0.612 . . . . 0.0 110.944 178.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.66 63.92 Favored Glycine 0 CA--C 1.541 1.663 0 C-N-CA 125.302 1.429 . . . . 0.0 115.648 -174.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.5 m -63.77 134.14 54.76 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.64 1.72 . . . . 0.0 111.191 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 38.6 mt -91.02 121.83 41.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 121.93 0.871 . . . . 0.0 109.3 169.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.2 mt -111.85 177.6 4.59 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.337 2.255 . . . . 0.0 110.434 176.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -139.24 145.89 39.78 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.144 1.778 . . . . 0.0 110.251 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.7 tp -85.11 140.16 31.17 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.718 0.807 . . . . 0.0 109.759 170.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -155.3 150.84 27.31 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.877 0.871 . . . . 0.0 111.061 -175.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.3 p -76.13 134.33 40.0 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.796 -1.19 . . . . 0.0 110.435 169.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.4 t -64.04 137.56 97.14 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 123.676 0.79 . . . . 0.0 112.122 -175.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -69.78 -10.46 28.59 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 123.689 2.926 . . . . 0.0 113.885 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -111.32 3.82 18.58 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.733 1.613 . . . . 0.0 114.078 -177.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -73.67 -33.27 64.38 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -168.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -75.66 -39.6 57.39 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.128 0.971 . . . . 0.0 112.248 176.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -157.61 138.57 13.31 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.995 2.118 . . . . 0.0 109.018 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -66.14 125.08 24.38 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.638 0.775 . . . . 0.0 112.245 -170.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.35 -19.23 60.52 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.314 1.045 . . . . 0.0 112.953 177.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 29.9 tp -147.81 141.95 26.07 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.304 1.842 . . . . 0.0 110.839 -176.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -133.16 -0.02 3.37 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.782 1.233 . . . . 0.0 114.299 -175.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -152.26 151.29 30.75 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.383 1.873 . . . . 0.0 109.786 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 22.0 tpt85 -74.19 74.15 1.78 Allowed 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.944 0.878 . . . . 0.0 112.292 178.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 77.6 mt -65.93 154.01 8.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 124.963 1.305 . . . . 0.0 107.756 167.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -55.59 -31.31 62.11 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -173.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.4 t -139.77 151.19 45.59 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.796 1.638 . . . . 0.0 110.789 169.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.8 m -69.29 -17.0 63.69 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -174.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 79.4 p -155.46 158.92 39.33 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.725 1.61 . . . . 0.0 111.661 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 94.2 mtp -72.63 -24.89 61.12 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -139.95 149.91 43.87 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.547 1.939 . . . . 0.0 111.019 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.69 -9.95 59.59 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -178.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -67.52 139.8 56.98 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.876 1.27 . . . . 0.0 112.549 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.4 mt -78.55 159.8 27.96 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.515 1.126 . . . . 0.0 111.479 169.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -140.67 163.6 32.45 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.281 1.432 . . . . 0.0 112.312 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -76.53 56.89 1.16 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.24 1.416 . . . . 0.0 112.776 176.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -63.5 -13.22 38.71 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.432 1.493 . . . . 0.0 114.779 -171.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -57.34 -27.77 62.54 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.689 1.196 . . . . 0.0 113.602 170.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -76.29 -30.34 57.74 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.182 0.993 . . . . 0.0 112.918 174.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.1 tp -87.21 -28.56 22.31 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.587 1.555 . . . . 0.0 113.052 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.02 143.05 49.56 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.157 1.383 . . . . 0.0 113.728 -174.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.3 m -73.64 -13.97 61.09 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.296 1.438 . . . . 0.0 114.607 -174.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 35.8 mt 60.18 9.3 1.83 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 127.294 2.238 . . . . 0.0 115.27 -174.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 23.9 t -161.13 156.87 25.03 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 127.521 2.328 . . . . 0.0 109.585 176.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -83.84 134.93 34.68 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.775 0.83 . . . . 0.0 112.584 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 . . . . . 0 C--O 1.254 1.316 0 C-N-CA 124.719 1.208 . . . . 0.0 113.203 169.899 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.699 0 N-CA-C 112.059 -0.416 . . . . 0.0 112.059 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt -69.79 156.2 92.15 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.006 0.922 . . . . 0.0 112.717 177.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -60.24 158.36 31.06 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.401 2.734 . . . . 0.0 113.967 175.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -60.03 154.32 51.9 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.451 2.767 . . . . 0.0 113.892 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -59.38 145.18 98.67 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.569 2.846 . . . . 0.0 113.811 176.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.63 158.43 33.66 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.227 1.011 . . . . 0.0 112.879 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 46.7 p-10 -83.78 10.1 10.32 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.547 1.539 . . . . 0.0 113.868 172.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.3 mt -137.51 135.94 46.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 126.37 1.868 . . . . 0.0 108.745 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.4 m -133.36 133.28 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.929 1.292 . . . . 0.0 112.091 -176.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -78.85 140.32 38.19 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.931 0.892 . . . . 0.0 111.376 176.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.51 157.64 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 125.82 1.648 . . . . 0.0 111.638 -177.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.16 28.49 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.622 1.169 . . . . 0.0 110.201 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.3 mt -106.22 127.29 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 124.352 1.061 . . . . 0.0 110.442 -171.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 67.5 mt-10 -89.24 149.53 23.05 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.038 1.335 . . . . 0.0 112.994 175.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -151.63 142.86 15.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 126.093 1.757 . . . . 0.0 110.053 170.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -60.91 137.19 70.77 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.545 2.163 . . . . 0.0 113.54 -175.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.67 12.49 74.1 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.454 0.941 . . . . 0.0 115.454 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -135.9 153.4 51.46 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.201 1.4 . . . . 0.0 112.765 -178.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -69.64 151.41 96.54 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 123.653 0.781 . . . . 0.0 111.33 170.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.1 130.32 33.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 122.592 2.195 . . . . 0.0 113.321 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -82.16 111.79 18.59 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.202 1.401 . . . . 0.0 110.234 175.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.8 127.87 33.11 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.404 0.682 . . . . 0.0 109.575 169.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -155.01 177.86 10.84 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.134 0.974 . . . . 0.0 111.602 173.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -113.34 135.07 54.26 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.933 . . . . 0.0 112.202 176.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.2 mt -95.57 110.01 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.721 1.608 . . . . 0.0 108.245 171.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -87.9 114.93 24.98 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.185 1.394 . . . . 0.0 110.074 175.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -70.9 -10.28 59.34 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -85.38 -21.93 28.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.372 1.069 . . . . 0.0 113.225 170.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -81.01 148.73 65.05 Favored Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 124.371 1.069 . . . . 0.0 112.781 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.05 146.39 76.87 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.94 2.427 . . . . 0.0 110.931 169.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -61.67 -29.85 70.35 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.556 177.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.7 t -58.7 -46.06 88.15 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.209 0.913 . . . . 0.0 112.232 172.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.14 -40.68 98.27 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.605 -0.684 . . . . 0.0 112.09 176.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 90.3 mt -66.42 -48.97 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 123.473 0.709 . . . . 0.0 110.568 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.6 mt -61.78 -36.88 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.389 1.076 . . . . 0.0 110.94 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.69 -40.5 92.46 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.791 0.836 . . . . 0.0 112.304 171.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -70.74 -25.81 63.09 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.355 1.062 . . . . 0.0 113.589 173.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.83 -61.93 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.865 1.211 . . . . 0.0 110.902 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 28.9 p -63.51 -33.79 76.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.777 0.831 . . . . 0.0 112.76 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -61.02 -28.61 69.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.905 0.882 . . . . 0.0 113.017 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.94 -23.24 69.27 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.242 0.925 . . . . 0.0 114.205 175.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.9 m-90 -115.79 12.99 16.04 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.864 1.666 . . . . 0.0 113.172 173.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m 55.78 27.04 10.23 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.0 1.72 . . . . 0.0 114.589 -176.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.53 130.8 37.42 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.212 1.405 . . . . 0.0 110.738 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.65 163.84 21.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.598 1.159 . . . . 0.0 113.789 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 52.61 68.81 0.77 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.686 1.994 . . . . 0.0 113.65 169.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -63.58 -17.77 63.19 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 -171.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -54.65 -32.95 59.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.505 1.522 . . . . 0.0 112.989 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -73.09 -21.29 60.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.388 1.075 . . . . 0.0 112.692 178.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -94.53 158.3 15.6 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.587 1.184 . . . . 0.0 114.159 -169.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -147.28 150.04 34.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.679 2.391 . . . . 0.0 109.725 173.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.3 mt -81.86 158.58 23.97 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 166.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -148.93 148.12 29.44 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.573 1.149 . . . . 0.0 110.243 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -67.24 130.75 44.09 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.933 -0.48 . . . . 0.0 111.69 172.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.26 2.96 54.99 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.634 1.174 . . . . 0.0 113.849 178.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -70.99 -171.34 0.54 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.184 1.794 . . . . 0.0 112.102 175.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.5 m -58.9 -26.95 64.78 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.414 -1.428 . . . . 0.0 112.515 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.5 t -93.39 136.26 33.83 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.038 1.335 . . . . 0.0 110.342 168.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -126.14 39.84 3.86 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.373 1.469 . . . . 0.0 112.419 -172.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -61.19 136.76 58.17 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.524 -0.735 . . . . 0.0 111.519 169.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -68.68 145.87 53.49 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 167.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.1 mm -76.07 136.54 24.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.764 0.792 . . . . 0.0 110.108 174.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.4 p -142.86 171.42 14.08 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.251 2.22 . . . . 0.0 108.768 -175.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -59.95 -18.15 43.25 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.361 -0.837 . . . . 0.0 113.131 176.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -89.59 -54.07 4.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.907 1.683 . . . . 0.0 111.391 168.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -69.6 -23.59 63.55 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.12 0.968 . . . . 0.0 113.126 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -55.46 -27.95 51.35 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -73.21 -18.06 61.29 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.334 1.054 . . . . 0.0 112.972 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -85.44 -13.97 47.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.668 1.187 . . . . 0.0 112.648 176.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 62.8 mt -66.54 137.85 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.657 1.183 . . . . 0.0 109.648 172.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -137.43 165.76 25.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.406 1.882 . . . . 0.0 111.828 -179.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.39 124.54 18.44 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.852 -0.53 . . . . 0.0 112.015 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.61 10.24 73.6 Favored Glycine 0 CA--C 1.539 1.532 0 C-N-CA 124.843 1.211 . . . . 0.0 115.514 -175.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 91.9 m -63.57 128.7 37.01 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.761 1.781 . . . . 0.0 110.792 175.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mt -86.82 123.23 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 171.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.6 mt -119.07 174.09 6.52 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.18 1.792 . . . . 0.0 110.957 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -139.2 135.5 34.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.544 1.938 . . . . 0.0 109.996 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.3 tp -79.47 135.9 36.78 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.071 0.548 . . . . 0.0 109.664 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 7.6 t -155.65 154.48 31.66 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.158 0.983 . . . . 0.0 110.216 -175.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.7 p -71.96 134.48 45.99 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.411 -1.431 . . . . 0.0 110.386 169.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t -58.55 141.51 83.89 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.298 1.039 . . . . 0.0 110.614 174.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -65.53 -15.56 50.11 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.639 2.226 . . . . 0.0 112.861 176.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -96.92 -10.16 26.96 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.237 1.415 . . . . 0.0 114.254 170.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 53.99 27.92 8.02 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.031 1.732 . . . . 0.0 113.936 -168.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -146.89 172.81 13.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 128.626 2.77 . . . . 0.0 108.727 173.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.33 128.58 34.83 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.514 -0.741 . . . . 0.0 111.777 176.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -81.43 53.8 2.17 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.344 1.458 . . . . 0.0 113.152 -169.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -68.14 136.99 54.55 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.572 1.549 . . . . 0.0 113.557 -172.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mp -74.86 132.72 41.71 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.489 1.116 . . . . 0.0 110.506 170.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -80.4 -25.77 38.87 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -158.81 151.29 21.69 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.721 1.608 . . . . 0.0 111.206 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 62.4 ttt-85 -74.9 116.24 15.41 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.277 1.031 . . . . 0.0 110.284 174.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.9 mt -71.37 -43.85 72.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.66 0.784 . . . . 0.0 111.439 -174.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.73 127.42 32.77 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.018 0.927 . . . . 0.0 110.756 175.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 78.7 p -75.79 -28.96 58.57 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -174.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 34.5 t -155.79 152.06 28.0 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.514 1.526 . . . . 0.0 111.17 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.4 t -74.55 65.84 1.33 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.562 1.545 . . . . 0.0 112.903 -176.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 69.6 mtm -69.66 162.02 28.52 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.183 1.793 . . . . 0.0 112.599 176.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -60.4 127.83 33.71 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.27 1.028 . . . . 0.0 111.692 177.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.49 -13.78 62.25 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -178.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -122.17 143.91 49.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.254 1.422 . . . . 0.0 112.776 -177.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 55.6 tp -84.42 131.73 34.64 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.412 1.485 . . . . 0.0 110.156 169.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -76.7 -34.38 58.17 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -177.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -164.32 155.65 15.73 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.94 1.696 . . . . 0.0 111.215 -179.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.92 133.44 50.9 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.678 -0.638 . . . . 0.0 110.42 170.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -74.3 134.88 42.58 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.884 0.874 . . . . 0.0 111.881 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -79.45 144.39 34.08 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.932 0.893 . . . . 0.0 111.877 171.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 96.4 mt -140.08 134.18 30.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.618 1.567 . . . . 0.0 110.609 177.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -158.9 156.23 29.17 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.588 1.555 . . . . 0.0 111.537 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.4 t -72.92 148.66 44.12 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.323 0.649 . . . . 0.0 112.092 171.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.3 mt -79.51 -9.48 59.62 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.573 1.149 . . . . 0.0 113.53 174.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 60.4 m -136.28 153.29 51.22 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.471 1.508 . . . . 0.0 112.759 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -68.52 -33.97 75.06 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.548 1.139 . . . . 0.0 112.982 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.4 t0 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.542 1.937 . . . . 0.0 111.822 -179.01 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.5 mtt -140.42 149.8 58.74 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.626 1.57 . . . . 0.0 111.574 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.18 159.22 54.7 Favored 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 123.415 2.744 . . . . 0.0 113.01 177.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -66.46 162.09 38.16 Favored 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 123.519 2.813 . . . . 0.0 112.309 172.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -76.24 53.23 3.79 Favored 'Trans proline' 0 CA--C 1.551 1.352 0 C-N-CA 124.957 3.771 . . . . 0.0 112.904 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 60.49 166.74 0.08 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 128.014 2.526 . . . . 0.0 115.05 -171.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -80.59 49.58 1.19 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.306 1.442 . . . . 0.0 112.143 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.5 mt -125.65 135.43 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.141 1.377 . . . . 0.0 110.557 -170.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.0 m -129.55 126.41 63.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.585 1.554 . . . . 0.0 111.597 -178.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -74.13 140.23 45.08 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.981 0.912 . . . . 0.0 110.84 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 m -137.91 154.45 28.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.13 1.372 . . . . 0.0 111.83 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.08 38.8 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.946 1.298 . . . . 0.0 109.615 171.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 52.4 mt -110.18 123.95 66.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 123.725 0.81 . . . . 0.0 110.38 -170.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -88.57 153.32 21.22 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.886 1.274 . . . . 0.0 113.238 176.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -153.76 142.48 14.47 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 126.134 1.773 . . . . 0.0 109.658 169.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -60.12 133.94 53.09 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.51 2.14 . . . . 0.0 113.295 -175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.93 11.04 78.37 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 115.409 0.924 . . . . 0.0 115.409 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -131.49 151.56 51.46 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.975 1.387 . . . . 0.0 112.805 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -70.34 150.27 95.83 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.703 0.801 . . . . 0.0 111.371 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -61.09 130.18 31.53 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.421 2.08 . . . . 0.0 113.383 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -83.55 111.15 18.82 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.121 1.368 . . . . 0.0 110.124 175.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.43 132.47 39.68 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.674 0.79 . . . . 0.0 110.227 169.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -157.24 178.08 10.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.411 1.085 . . . . 0.0 111.688 177.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -122.21 131.25 53.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.492 1.117 . . . . 0.0 112.174 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.3 mt -100.19 109.79 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 125.636 1.575 . . . . 0.0 108.864 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -81.14 117.85 22.04 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 168.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -65.05 -13.89 59.08 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -86.22 -22.21 27.03 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.758 1.223 . . . . 0.0 114.087 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -86.13 149.56 50.34 Favored Pre-proline 0 N--CA 1.483 1.181 0 CA-C-N 119.778 1.172 . . . . 0.0 111.691 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.47 144.01 39.74 Favored 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.067 2.512 . . . . 0.0 112.337 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.4 mt -61.77 -31.73 71.95 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.445 0.698 . . . . 0.0 112.438 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.4 m -59.38 -42.4 91.61 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.168 0.894 . . . . 0.0 112.301 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.5 81.83 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.145 0.578 . . . . 0.0 111.902 175.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.81 -50.76 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 123.492 0.717 . . . . 0.0 110.581 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.5 mt -61.51 -38.54 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.073 -1.017 . . . . 0.0 110.865 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -61.3 -38.95 88.68 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.721 0.809 . . . . 0.0 112.552 171.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -72.25 -27.81 62.74 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.396 1.079 . . . . 0.0 113.488 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.41 -61.11 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.259 -0.9 . . . . 0.0 111.098 172.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 30.2 p -61.55 -33.45 73.86 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.582 0.753 . . . . 0.0 112.849 -171.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -60.27 -30.85 69.72 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.325 1.05 . . . . 0.0 112.893 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.27 -23.13 67.93 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.378 0.989 . . . . 0.0 114.064 175.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.8 m0 -114.9 12.36 16.85 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.955 1.702 . . . . 0.0 113.307 173.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.3 p 55.93 22.67 5.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 127.284 2.233 . . . . 0.0 115.4 -176.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.62 125.99 28.8 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.083 1.353 . . . . 0.0 110.677 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.0 166.2 22.6 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.636 1.174 . . . . 0.0 113.4 -177.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 m120 54.06 63.13 2.29 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.984 1.714 . . . . 0.0 113.397 171.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -59.85 -25.44 65.03 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.208 -0.933 . . . . 0.0 113.482 -174.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -64.73 -15.84 62.08 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.852 1.261 . . . . 0.0 113.89 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -77.81 -20.87 52.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.161 -0.962 . . . . 0.0 112.407 168.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -94.38 160.81 14.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.903 1.281 . . . . 0.0 114.145 -169.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.43 157.38 43.76 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.829 2.451 . . . . 0.0 109.917 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 40.3 mt -87.41 151.69 22.86 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 167.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -139.22 144.4 38.46 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.813 1.245 . . . . 0.0 109.959 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -65.0 141.42 58.78 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.061 0.544 . . . . 0.0 112.377 176.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -129.26 -28.99 2.28 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.893 1.277 . . . . 0.0 112.776 174.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -70.56 -47.76 58.7 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.466 -0.771 . . . . 0.0 110.821 168.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 t -84.83 -177.07 6.49 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.937 1.295 . . . . 0.0 111.408 169.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.4 t -60.31 162.11 6.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.868 0.867 . . . . 0.0 111.718 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.99 38.61 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 127.341 2.257 . . . . 0.0 116.969 -169.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -68.35 135.48 51.88 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.136 -1.603 . . . . 0.0 111.697 173.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -70.8 144.74 50.72 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.678 -0.639 . . . . 0.0 110.645 169.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.7 mm -77.92 134.06 29.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.507 0.723 . . . . 0.0 109.673 173.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.4 p -139.31 169.55 17.56 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.97 1.708 . . . . 0.0 109.776 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -58.41 -21.29 50.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.099 0.96 . . . . 0.0 113.385 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -93.59 -47.48 6.8 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.295 1.438 . . . . 0.0 112.667 169.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -76.64 -17.25 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -54.29 -25.45 23.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.967 1.307 . . . . 0.0 114.231 171.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -67.54 -15.87 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.072 0.949 . . . . 0.0 113.512 176.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -79.17 -11.63 59.97 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.077 0.951 . . . . 0.0 113.426 171.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 74.0 mt -71.53 134.47 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 O-C-N 121.272 -0.893 . . . . 0.0 109.771 173.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -121.5 166.36 14.27 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.843 2.057 . . . . 0.0 111.629 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -57.57 124.03 17.64 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 121.855 -0.528 . . . . 0.0 110.738 173.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.51 11.59 68.54 Favored Glycine 0 CA--C 1.539 1.549 0 C-N-CA 125.11 1.338 . . . . 0.0 115.465 -177.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.4 m -65.12 131.62 47.02 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 119.455 1.628 . . . . 0.0 111.599 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.3 mt -85.31 124.4 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 169.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.6 mt -119.46 174.65 6.25 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.845 2.058 . . . . 0.0 110.263 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ttp85 -141.92 137.46 31.32 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.938 1.695 . . . . 0.0 110.181 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -77.09 139.84 40.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.956 0.902 . . . . 0.0 110.595 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.2 t -157.35 151.38 24.6 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.976 0.911 . . . . 0.0 111.242 -176.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.0 p -69.86 126.71 30.51 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.565 -1.335 . . . . 0.0 110.321 169.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 45.0 t -65.0 140.84 98.23 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 125.121 1.369 . . . . 0.0 111.875 -177.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.17 -29.57 56.91 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.002 2.468 . . . . 0.0 113.313 172.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.96 -19.9 47.45 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -72.09 -10.13 59.36 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.391 0.996 . . . . 0.0 113.574 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -137.49 -61.15 0.65 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.821 1.248 . . . . 0.0 112.97 178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -162.65 137.68 6.82 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.407 1.483 . . . . 0.0 111.714 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -146.13 72.77 1.31 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.679 1.192 . . . . 0.0 110.799 178.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -71.43 150.88 44.52 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.427 1.091 . . . . 0.0 112.894 -178.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.2 tp -67.82 150.5 48.53 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.519 1.128 . . . . 0.0 111.509 171.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.1 p80 -138.98 157.94 45.1 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.117 1.367 . . . . 0.0 112.304 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -80.98 65.53 6.16 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.275 1.43 . . . . 0.0 113.032 -171.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -0.96 1.87 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.6 1.56 . . . . 0.0 114.821 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 94.3 mt -54.58 -36.29 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.999 1.32 . . . . 0.0 111.269 175.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -88.06 133.77 33.9 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.801 1.24 . . . . 0.0 112.795 173.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 49.0 p -163.19 152.0 14.42 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.759 1.624 . . . . 0.0 111.148 169.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.9 t -71.46 149.82 45.51 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.807 0.843 . . . . 0.0 112.983 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 80.0 p -77.22 -7.66 56.28 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.324 1.45 . . . . 0.0 113.675 171.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 76.9 mtm -134.35 165.08 25.97 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.953 1.701 . . . . 0.0 112.307 -176.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -149.67 164.73 34.4 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.151 1.38 . . . . 0.0 111.512 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.36 159.37 34.13 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.656 1.182 . . . . 0.0 112.711 174.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 32.6 tttp 59.86 22.24 11.2 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.386 1.875 . . . . 0.0 115.283 173.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.3 mt -77.52 -24.11 50.05 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.221 1.009 . . . . 0.0 113.129 174.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -74.78 153.21 38.88 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.506 1.523 . . . . 0.0 113.085 176.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -153.23 155.4 36.53 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.935 1.294 . . . . 0.0 112.272 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.1 pp -72.6 165.19 25.19 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.539 1.135 . . . . 0.0 112.539 172.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -144.53 152.75 41.02 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.23 1.412 . . . . 0.0 112.665 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 39.2 p-10 -88.65 174.39 8.07 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.649 1.58 . . . . 0.0 112.315 171.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 94.9 mt -126.35 151.38 47.67 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.882 1.673 . . . . 0.0 111.132 175.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -152.67 171.35 18.32 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.216 1.406 . . . . 0.0 112.315 -175.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 40.3 t -145.65 148.71 33.37 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.419 1.488 . . . . 0.0 111.728 176.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 84.2 mt -75.91 -11.42 59.96 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.68 1.192 . . . . 0.0 113.213 173.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.7 t 54.47 47.84 21.89 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.354 1.462 . . . . 0.0 112.197 -173.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -62.05 134.82 57.11 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.698 1.599 . . . . 0.0 112.15 -173.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 . . . . . 0 C--O 1.253 1.249 0 C-N-CA 126.632 1.973 . . . . 0.0 113.242 174.897 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.0 mmm 63.26 159.28 0.12 Allowed Pre-proline 0 N--CA 1.482 1.149 0 C-N-CA 127.342 2.257 . . . . 0.0 114.838 -173.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -61.59 141.06 90.07 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 122.951 2.434 . . . . 0.0 113.335 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.51 150.33 87.91 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.215 2.61 . . . . 0.0 113.369 175.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.54 3.25 5.52 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.938 3.092 . . . . 0.0 115.043 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.29 4.03 21.96 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.273 1.829 . . . . 0.0 113.873 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.0 p-10 -75.63 7.16 3.97 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.698 1.599 . . . . 0.0 115.167 -178.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.6 mt -137.29 134.95 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 125.97 1.708 . . . . 0.0 108.89 170.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.5 m -135.48 132.82 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.056 1.342 . . . . 0.0 112.136 -177.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -71.34 141.14 50.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.98 0.912 . . . . 0.0 111.396 172.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.3 m -141.81 155.14 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.942 1.297 . . . . 0.0 111.927 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -114.81 120.16 39.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.898 1.279 . . . . 0.0 109.792 171.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -109.18 125.23 66.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.922 0.889 . . . . 0.0 110.48 -172.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -91.89 151.05 20.73 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.879 1.272 . . . . 0.0 113.381 177.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -151.35 143.38 16.08 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.069 1.748 . . . . 0.0 109.937 170.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_exo -59.67 135.16 62.25 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.544 2.162 . . . . 0.0 113.505 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.58 11.32 76.92 Favored Glycine 0 CA--C 1.539 1.571 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -132.81 152.37 51.82 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.873 1.336 . . . . 0.0 112.866 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -70.44 152.18 95.51 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 123.689 0.796 . . . . 0.0 111.515 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.34 129.72 29.37 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.5 2.133 . . . . 0.0 113.265 -178.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -82.56 109.31 16.65 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.205 1.402 . . . . 0.0 110.05 174.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 78.3 mt -75.8 131.9 40.06 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.723 0.809 . . . . 0.0 110.205 170.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -156.48 178.19 10.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.198 0.999 . . . . 0.0 112.067 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -118.58 122.45 42.65 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.701 1.2 . . . . 0.0 111.474 174.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.3 mt -84.78 108.46 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 124.425 1.09 . . . . 0.0 108.257 169.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -81.77 114.86 20.7 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.094 0.957 . . . . 0.0 108.825 169.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.01 -12.07 60.1 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 -175.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -88.44 -23.06 23.39 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.761 1.224 . . . . 0.0 113.422 172.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -78.94 143.07 61.1 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 124.182 0.993 . . . . 0.0 111.295 174.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.52 144.41 66.75 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.089 2.526 . . . . 0.0 111.411 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.8 mt -61.69 -30.06 70.5 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 118.78 -0.629 . . . . 0.0 112.615 178.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.3 p -59.98 -44.68 94.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.644 1.111 . . . . 0.0 112.402 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.72 -40.02 88.25 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.263 0.625 . . . . 0.0 112.055 174.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.7 -46.89 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.585 0.754 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.05 -37.02 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.581 1.153 . . . . 0.0 111.077 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -61.49 -38.62 87.97 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.743 0.701 . . . . 0.0 112.32 171.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -72.03 -25.13 61.69 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.329 1.052 . . . . 0.0 113.337 174.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 46.4 t -72.07 -57.6 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.277 0.944 . . . . 0.0 110.976 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 14.7 p -62.18 -33.76 75.14 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.865 0.866 . . . . 0.0 112.562 -169.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.17 -28.94 69.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.557 1.143 . . . . 0.0 113.029 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.11 -23.0 69.41 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.303 0.954 . . . . 0.0 114.088 175.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -117.73 10.28 13.28 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.052 1.741 . . . . 0.0 113.193 174.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.0 t 54.69 33.6 19.77 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.274 1.83 . . . . 0.0 113.865 -176.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.5 mt -80.69 125.21 29.75 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.708 1.203 . . . . 0.0 110.489 179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.26 165.82 22.81 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.77 1.228 . . . . 0.0 113.245 -178.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 54.03 59.83 4.0 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.922 1.689 . . . . 0.0 113.569 172.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -60.24 -19.97 56.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -176.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -56.27 -29.27 60.9 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.237 1.415 . . . . 0.0 112.913 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.6 m-30 -78.9 -19.75 51.11 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.015 0.926 . . . . 0.0 112.726 178.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -91.16 158.32 16.69 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -169.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.73 150.67 35.82 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.354 2.262 . . . . 0.0 110.086 172.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -82.54 153.45 25.53 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 167.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -145.4 150.36 36.4 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.826 1.25 . . . . 0.0 109.698 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -63.42 138.86 58.67 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.487 -0.758 . . . . 0.0 111.146 173.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.96 -8.7 57.86 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 -174.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -67.31 176.55 2.21 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.918 1.287 . . . . 0.0 112.983 175.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 17.5 m -63.72 -10.77 21.27 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 99.4 p -70.67 165.55 22.67 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.355 1.462 . . . . 0.0 112.852 172.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -102.09 12.44 36.8 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.586 1.554 . . . . 0.0 113.712 178.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 12.4 m-30 -63.57 100.08 0.25 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.382 1.073 . . . . 0.0 113.183 -169.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -70.95 143.37 50.91 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.762 0.825 . . . . 0.0 110.964 170.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.4 mm -82.19 129.6 37.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 124.375 1.07 . . . . 0.0 109.283 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.7 p -142.53 167.19 22.68 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.619 1.568 . . . . 0.0 109.965 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -63.1 -10.01 12.91 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 120.979 -1.076 . . . . 0.0 113.451 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -105.68 -4.88 20.49 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.517 1.927 . . . . 0.0 114.406 173.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -130.22 -14.48 3.83 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -174.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -61.55 -18.47 59.38 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 178.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -63.47 -22.58 66.97 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.869 1.268 . . . . 0.0 112.959 174.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -75.15 -14.17 60.53 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.987 0.915 . . . . 0.0 113.184 177.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.7 mt -73.77 132.64 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.472 1.109 . . . . 0.0 110.172 177.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -118.13 167.31 11.6 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.144 1.778 . . . . 0.0 111.886 170.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -59.41 127.27 31.23 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.633 -0.667 . . . . 0.0 110.979 172.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 87.77 10.35 69.96 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.041 1.305 . . . . 0.0 115.305 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.5 m -65.98 131.39 46.13 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.563 1.682 . . . . 0.0 111.084 175.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mt -89.74 125.02 42.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 172.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 89.5 mt -120.37 173.45 7.13 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.679 1.992 . . . . 0.0 110.578 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -139.83 146.88 39.93 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.793 1.637 . . . . 0.0 110.594 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.7 tp -85.22 138.98 32.0 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.219 1.008 . . . . 0.0 110.173 173.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.7 t -157.65 156.37 31.66 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.157 0.983 . . . . 0.0 110.871 -176.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.4 p -71.02 139.26 50.43 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.415 -1.428 . . . . 0.0 110.568 169.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.9 p -63.05 158.49 54.36 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 126.011 1.724 . . . . 0.0 113.635 -171.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -67.49 -26.01 40.89 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.078 1.852 . . . . 0.0 112.11 169.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.22 -31.26 71.5 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.72 1.208 . . . . 0.0 113.74 -177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.42 -10.82 59.69 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 177.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -90.33 143.31 26.88 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.413 1.085 . . . . 0.0 112.619 -176.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . 57.28 179.44 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.957 2.103 . . . . 0.0 115.762 175.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -70.3 142.28 52.26 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.838 1.255 . . . . 0.0 111.604 175.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -83.01 -14.05 54.72 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 52.6 tp -69.44 139.21 54.0 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.973 1.309 . . . . 0.0 112.359 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 35.0 p80 -151.81 167.55 27.91 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.5 1.52 . . . . 0.0 111.799 176.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -151.03 164.87 35.43 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.512 1.525 . . . . 0.0 111.717 176.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -140.9 145.54 36.25 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.726 1.611 . . . . 0.0 111.811 -177.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 39.8 pt -69.07 158.78 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.922 1.289 . . . . 0.0 112.901 178.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -143.38 27.48 1.55 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.462 1.505 . . . . 0.0 112.584 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 79.4 p -69.71 -17.36 63.46 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -171.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 33.8 t -153.12 143.05 22.17 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.76 1.224 . . . . 0.0 112.283 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.2 t -160.48 155.19 23.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.293 1.837 . . . . 0.0 110.661 175.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 91.0 mtp -75.62 133.77 40.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.841 0.856 . . . . 0.0 111.839 177.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -72.96 -28.5 62.46 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -153.99 151.99 30.03 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.94 1.696 . . . . 0.0 111.051 176.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -138.9 107.32 5.82 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.596 1.558 . . . . 0.0 110.681 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.9 mt -84.02 -32.71 24.76 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.354 1.062 . . . . 0.0 113.464 -176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 51.74 34.88 13.87 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.514 1.926 . . . . 0.0 114.615 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.36 139.09 58.53 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.829 1.252 . . . . 0.0 113.367 -175.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.7 mt -82.71 162.9 21.63 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.058 1.343 . . . . 0.0 112.128 174.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -146.31 150.08 35.07 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.3 1.44 . . . . 0.0 112.547 175.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -93.68 151.34 19.72 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.846 1.259 . . . . 0.0 111.763 172.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 96.5 mt -138.44 143.59 39.75 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.713 1.605 . . . . 0.0 110.889 176.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.85 153.17 37.0 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.183 0.993 . . . . 0.0 112.962 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.0 p -155.71 149.99 25.75 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.202 1.401 . . . . 0.0 111.824 175.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -156.65 161.6 39.88 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.721 1.608 . . . . 0.0 111.98 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 22.6 t -154.58 155.13 34.19 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.146 1.378 . . . . 0.0 111.539 174.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -75.65 164.27 26.47 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.174 1.39 . . . . 0.0 112.396 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 . . . . . 0 C--O 1.254 1.32 0 C-N-CA 127.342 2.257 . . . . 0.0 114.002 175.379 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.669 0 N-CA-C 112.076 -0.41 . . . . 0.0 112.076 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.6 tpt -149.81 126.27 5.24 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 125.283 1.433 . . . . 0.0 110.52 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -71.74 160.09 49.01 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 123.036 2.491 . . . . 0.0 112.868 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -59.73 153.56 55.3 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.489 2.792 . . . . 0.0 113.51 173.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -65.79 148.71 86.82 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.318 2.679 . . . . 0.0 112.229 175.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.89 153.96 38.41 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.077 0.951 . . . . 0.0 113.251 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -85.63 15.84 4.35 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.439 1.496 . . . . 0.0 114.068 178.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 63.6 mt -66.42 139.88 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.252 1.421 . . . . 0.0 111.416 -175.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.5 m -133.67 135.36 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.033 1.733 . . . . 0.0 111.52 178.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.3 tttp -77.91 145.88 35.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.168 0.987 . . . . 0.0 110.873 172.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.9 m -141.73 155.5 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.777 1.631 . . . . 0.0 111.563 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.62 113.28 20.99 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.922 1.289 . . . . 0.0 109.992 174.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.7 mt -102.07 126.21 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.763 0.825 . . . . 0.0 110.839 -170.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -82.9 143.1 30.96 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.722 1.609 . . . . 0.0 112.754 175.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -156.03 142.99 13.58 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 125.817 1.647 . . . . 0.0 110.429 170.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -63.24 143.9 90.55 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.699 2.266 . . . . 0.0 113.775 -174.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.81 12.84 71.42 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 115.476 0.95 . . . . 0.0 115.476 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -142.11 157.32 45.03 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.201 1.4 . . . . 0.0 112.641 -177.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -70.21 154.1 94.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 123.762 0.825 . . . . 0.0 111.452 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.86 129.8 32.12 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.647 2.232 . . . . 0.0 112.746 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -81.15 109.63 15.88 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.095 0.958 . . . . 0.0 110.303 176.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.4 mt -76.91 126.16 30.51 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.48 0.712 . . . . 0.0 109.664 169.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 25.4 ptm -154.15 178.47 9.95 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.115 0.966 . . . . 0.0 111.766 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -115.96 137.72 51.85 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.401 1.081 . . . . 0.0 111.983 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.8 mt -105.33 114.03 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 C-N-CA 126.014 1.726 . . . . 0.0 108.717 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -87.53 119.93 28.33 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.887 0.875 . . . . 0.0 109.071 168.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -65.93 -15.07 62.64 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -83.95 -21.2 31.88 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.621 1.168 . . . . 0.0 113.977 172.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -80.2 146.97 63.81 Favored Pre-proline 0 N--CA 1.481 1.08 0 CA-C-N 119.386 0.994 . . . . 0.0 111.902 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.67 142.42 52.98 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 122.724 2.283 . . . . 0.0 111.06 174.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.5 mt -62.82 -29.61 70.86 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.298 179.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.6 p -60.83 -44.12 97.37 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.419 1.009 . . . . 0.0 112.576 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.87 87.63 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.574 0.625 . . . . 0.0 112.096 175.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.56 -48.38 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.345 0.658 . . . . 0.0 110.282 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -36.08 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.458 1.103 . . . . 0.0 111.213 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -59.68 -44.7 93.51 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.146 0.885 . . . . 0.0 112.066 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -66.51 -29.31 69.38 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.338 1.055 . . . . 0.0 113.074 174.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.92 -55.43 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.343 0.974 . . . . 0.0 110.514 169.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.07 -41.3 99.41 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.835 0.854 . . . . 0.0 112.182 -173.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.81 -27.29 68.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.634 0.774 . . . . 0.0 112.91 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.63 -23.58 67.15 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.425 1.012 . . . . 0.0 114.3 174.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -117.51 16.19 14.64 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.92 1.688 . . . . 0.0 113.144 172.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.1 m 55.59 26.42 9.14 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.92 1.688 . . . . 0.0 114.55 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.3 mt -72.46 125.41 27.35 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.113 1.365 . . . . 0.0 111.405 -178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.16 152.93 41.95 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.353 1.061 . . . . 0.0 112.352 176.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 49.27 68.11 0.78 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.458 1.903 . . . . 0.0 113.232 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -57.45 -17.25 12.29 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.971 1.308 . . . . 0.0 113.425 177.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -54.86 -27.93 46.21 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.705 1.602 . . . . 0.0 112.914 173.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -76.61 -18.37 58.65 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.938 0.895 . . . . 0.0 112.87 178.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -95.82 159.96 14.72 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -168.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.42 145.82 32.13 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.584 2.354 . . . . 0.0 109.563 172.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.46 154.96 28.53 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.456 0.646 . . . . 0.0 109.27 167.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -144.95 149.16 34.73 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 124.973 1.309 . . . . 0.0 110.019 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 -66.05 150.93 47.93 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.678 -0.639 . . . . 0.0 111.871 170.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.4 -21.02 1.05 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.357 1.063 . . . . 0.0 113.671 169.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -70.9 -72.55 0.2 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.466 1.106 . . . . 0.0 112.955 177.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 64.8 m -94.13 -19.11 21.1 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -172.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 t -161.36 -173.36 3.78 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.444 1.497 . . . . 0.0 111.35 -174.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -121.74 22.28 10.54 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.04 2.136 . . . . 0.0 112.6 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -61.38 136.94 58.21 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.7 -1.25 . . . . 0.0 111.925 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -70.22 141.54 52.5 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.736 -0.602 . . . . 0.0 109.712 168.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.6 mm -74.59 135.45 27.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.169 0.588 . . . . 0.0 110.291 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.2 p -142.12 173.02 11.9 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.775 2.03 . . . . 0.0 109.436 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -57.82 -22.69 48.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -90.32 -48.94 6.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.824 1.25 . . . . 0.0 112.362 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -74.79 -20.13 59.92 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.162 0.985 . . . . 0.0 113.306 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -54.99 -26.53 37.5 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.423 1.089 . . . . 0.0 113.843 171.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -72.6 -15.92 61.73 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.317 1.047 . . . . 0.0 113.376 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -78.22 -13.04 60.02 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.162 0.985 . . . . 0.0 112.894 172.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.0 mt -70.52 129.99 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 123.98 0.912 . . . . 0.0 109.65 174.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -111.47 165.29 12.11 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.247 1.819 . . . . 0.0 111.867 170.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -61.29 125.5 23.97 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.604 -0.685 . . . . 0.0 110.929 174.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 85.67 13.71 69.44 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 125.039 1.304 . . . . 0.0 115.392 -174.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 95.0 m -64.55 131.0 45.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 119.763 1.782 . . . . 0.0 111.69 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.6 mt -80.68 121.32 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 168.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -113.91 177.96 4.45 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.333 1.853 . . . . 0.0 110.455 176.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.6 ttp180 -143.18 136.27 27.98 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 126.813 2.045 . . . . 0.0 110.285 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.4 tp -82.11 137.65 34.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.274 0.63 . . . . 0.0 109.734 169.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.1 t -155.87 154.63 31.57 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.121 0.968 . . . . 0.0 110.241 -177.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.5 p -70.03 141.0 52.94 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.547 -1.346 . . . . 0.0 110.571 170.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.2 t -58.84 147.06 73.82 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 125.767 1.627 . . . . 0.0 113.164 -172.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.14 -21.8 55.14 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 122.808 2.339 . . . . 0.0 112.804 171.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -87.96 -59.33 2.27 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.834 1.254 . . . . 0.0 111.984 171.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 50.32 33.06 6.93 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.968 2.107 . . . . 0.0 115.242 -176.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -150.03 154.04 37.51 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.967 1.307 . . . . 0.0 111.712 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -150.12 81.95 1.37 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.78 1.632 . . . . 0.0 110.675 -178.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -62.54 -23.71 67.13 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 13.3 pm0 -77.3 -1.49 30.07 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.297 1.839 . . . . 0.0 114.779 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 60.3 tp -58.8 123.66 17.19 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.717 1.207 . . . . 0.0 112.822 -176.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -77.82 162.25 27.04 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.184 1.394 . . . . 0.0 113.287 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.8 mp0 -64.85 157.73 27.03 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.189 1.396 . . . . 0.0 112.848 173.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -64.27 139.84 58.81 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.785 1.234 . . . . 0.0 112.051 178.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.2 pt -136.19 159.18 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 126.5 1.92 . . . . 0.0 111.448 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -71.97 147.22 47.15 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.997 0.919 . . . . 0.0 112.269 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 64.3 m -100.51 149.73 23.4 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.953 1.301 . . . . 0.0 112.626 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 37.2 m -68.26 154.1 42.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.717 1.207 . . . . 0.0 112.8 174.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 93.3 p -138.3 -4.17 1.69 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -177.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 62.6 ttp -62.42 -27.21 68.94 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.026 -1.046 . . . . 0.0 113.464 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -68.16 -8.63 40.21 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.868 1.267 . . . . 0.0 114.348 178.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.32 -20.03 65.98 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 69.1 tttt 53.19 31.96 12.45 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.352 1.861 . . . . 0.0 113.798 177.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.9 pp -71.02 -8.63 54.71 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -169.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -82.15 12.9 3.8 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.679 1.592 . . . . 0.0 115.237 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.83 152.36 12.72 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.087 1.755 . . . . 0.0 113.724 171.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.6 mt -135.79 155.11 50.86 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.015 1.726 . . . . 0.0 111.596 179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.15 -9.76 1.74 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.954 1.835 . . . . 0.0 115.954 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -82.7 47.41 1.19 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.257 1.423 . . . . 0.0 112.874 -176.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 9.3 mp -75.29 147.37 40.25 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.019 1.328 . . . . 0.0 111.53 -178.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -152.11 160.21 43.47 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.269 1.428 . . . . 0.0 112.161 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.7 t -70.63 -32.8 70.24 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.026 0.93 . . . . 0.0 112.696 175.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.04 136.12 55.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.003 1.321 . . . . 0.0 111.82 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 27.1 m -63.21 140.05 58.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.591 1.157 . . . . 0.0 113.063 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -72.72 146.74 46.23 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.89 1.276 . . . . 0.0 111.588 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.16 1.384 . . . . 0.0 113.711 176.729 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 112.117 -0.393 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.9 ttp -65.65 136.41 95.98 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.334 1.054 . . . . 0.0 111.74 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.18 152.91 78.92 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.036 2.491 . . . . 0.0 112.705 177.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -70.33 156.62 61.45 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.434 2.756 . . . . 0.0 112.442 178.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -77.65 42.9 1.24 Allowed 'Trans proline' 0 CA--C 1.551 1.351 0 C-N-CA 124.78 3.653 . . . . 0.0 112.517 174.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -150.43 162.8 39.87 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.001 1.72 . . . . 0.0 112.009 -172.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 58.0 26.55 13.61 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.842 1.657 . . . . 0.0 114.332 -177.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 19.6 mt -106.25 144.24 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 125.35 1.46 . . . . 0.0 111.307 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.41 129.83 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 126.27 1.828 . . . . 0.0 110.867 175.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -73.61 143.32 46.41 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.956 0.902 . . . . 0.0 110.397 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.5 m -139.36 151.36 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.196 1.398 . . . . 0.0 111.171 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.09 129.01 56.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.526 1.13 . . . . 0.0 109.95 171.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.2 mt -118.44 122.58 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 123.865 0.866 . . . . 0.0 110.821 -169.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -81.73 141.54 33.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.276 1.43 . . . . 0.0 112.86 175.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . 0.43 ' CD2' ' HD2' ' A' ' 15' ' ' PRO . 68.6 t-105 -158.84 139.53 9.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.677 1.991 . . . . 0.0 109.626 169.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.43 ' HD2' ' CD2' ' A' ' 14' ' ' TRP . 59.2 Cg_endo -68.08 150.59 77.49 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 123.131 2.554 . . . . 0.0 113.204 -173.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 73.46 9.96 78.55 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.188 0.899 . . . . 0.0 115.151 -179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.12 160.5 42.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.635 1.574 . . . . 0.0 112.248 -178.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -71.28 155.94 92.32 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 124.008 0.923 . . . . 0.0 111.743 170.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.36 126.95 22.24 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.871 2.381 . . . . 0.0 112.312 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -83.76 115.77 22.38 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.101 0.96 . . . . 0.0 110.973 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.48 130.93 35.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.247 0.619 . . . . 0.0 109.808 168.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.2 ppp? -151.16 173.66 14.14 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.537 1.135 . . . . 0.0 110.998 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -126.79 114.23 17.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.21 1.004 . . . . 0.0 111.513 -173.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.7 mt -86.4 116.02 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 C-N-CA 125.476 1.51 . . . . 0.0 109.744 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -82.51 117.84 22.81 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 167.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.0 -9.64 41.13 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -91.34 -19.89 22.44 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 170.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -87.16 148.58 45.32 Favored Pre-proline 0 N--CA 1.485 1.309 0 CA-C-N 120.225 1.375 . . . . 0.0 111.967 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.57 146.92 56.46 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 123.415 2.743 . . . . 0.0 112.577 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.84 -30.14 71.26 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 118.245 -0.883 . . . . 0.0 113.103 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.2 t -58.92 -45.23 90.83 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.991 1.269 . . . . 0.0 111.61 173.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.23 95.33 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.765 -0.584 . . . . 0.0 112.26 175.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 60.6 mt -60.9 -51.91 67.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.683 0.793 . . . . 0.0 111.251 175.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.4 mt -61.57 -39.83 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 123.943 0.897 . . . . 0.0 110.017 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -58.57 -43.61 89.45 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.758 0.708 . . . . 0.0 112.368 171.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -69.91 -26.33 64.11 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.565 1.146 . . . . 0.0 112.903 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 99.6 t -71.0 -61.39 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.919 0.888 . . . . 0.0 110.093 169.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -55.37 -39.2 69.82 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.56 1.544 . . . . 0.0 113.764 -173.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.87 -29.77 68.53 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.56 -29.79 72.94 Favored Glycine 0 CA--C 1.534 1.257 0 O-C-N 121.291 -0.881 . . . . 0.0 113.897 177.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -99.22 14.03 30.91 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.192 1.397 . . . . 0.0 112.883 171.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p 57.67 20.68 6.56 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.467 2.307 . . . . 0.0 115.322 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -72.39 113.42 9.42 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.877 1.271 . . . . 0.0 110.889 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.18 162.99 28.39 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.308 1.043 . . . . 0.0 112.207 174.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.5 m120 54.16 65.26 1.56 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.724 1.609 . . . . 0.0 112.777 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 32.3 p-80 -62.77 -14.34 43.7 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.353 1.061 . . . . 0.0 113.333 -177.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -54.57 -29.48 51.38 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.274 1.83 . . . . 0.0 113.407 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -74.98 -21.22 59.28 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.545 1.138 . . . . 0.0 112.86 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -98.24 160.01 14.57 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -168.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -152.24 156.42 39.69 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.305 2.242 . . . . 0.0 110.137 169.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.7 mt -80.32 154.53 27.73 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 167.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -142.17 144.8 33.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.655 1.182 . . . . 0.0 110.372 176.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -63.05 139.87 58.82 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 178.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.98 -23.94 6.72 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.92 1.288 . . . . 0.0 112.88 170.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -73.02 -6.35 44.92 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.609 1.164 . . . . 0.0 113.946 169.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.9 t -146.3 -166.25 2.42 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.036 1.734 . . . . 0.0 110.796 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 71.3 m -60.49 165.35 3.77 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.198 0.999 . . . . 0.0 112.113 170.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -71.35 45.11 0.1 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.569 1.948 . . . . 0.0 115.198 -171.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -67.96 118.49 11.22 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.59 -1.319 . . . . 0.0 110.857 173.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -67.67 141.67 56.61 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.866 0.467 . . . . 0.0 109.958 169.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 39.8 mm -80.14 135.65 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 123.849 0.859 . . . . 0.0 110.409 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -143.78 168.93 18.75 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.15 2.18 . . . . 0.0 108.86 -177.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -61.3 -15.55 36.63 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.367 -0.833 . . . . 0.0 113.229 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -87.99 -50.4 6.44 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.321 1.448 . . . . 0.0 112.082 168.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -77.22 -19.63 56.41 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.992 1.317 . . . . 0.0 114.375 -168.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -58.32 -17.91 23.39 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -66.23 -19.21 65.76 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 173.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -75.43 -16.14 60.37 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.134 0.974 . . . . 0.0 113.113 173.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 64.9 mt -75.67 128.65 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 123.967 0.907 . . . . 0.0 109.688 177.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -120.6 168.38 11.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.255 1.822 . . . . 0.0 111.842 171.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -61.16 121.96 13.84 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.613 -0.679 . . . . 0.0 111.312 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.23 10.19 62.61 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.438 1.494 . . . . 0.0 115.594 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.0 m -64.81 131.33 46.5 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 119.692 1.746 . . . . 0.0 111.861 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 43.7 mt -87.2 125.9 40.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.85 0.86 . . . . 0.0 109.784 169.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.1 mt -124.79 176.75 6.39 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.877 2.471 . . . . 0.0 109.924 179.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt85 -136.61 149.07 47.81 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.846 1.259 . . . . 0.0 110.814 168.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.2 tp -82.98 138.81 33.63 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 8.9 t -157.52 156.53 32.19 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.165 0.986 . . . . 0.0 110.67 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 26.8 p -70.63 132.44 45.45 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.62 -1.3 . . . . 0.0 110.418 169.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 p -68.47 164.78 41.13 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 125.339 1.456 . . . . 0.0 112.498 -176.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.85 -25.43 9.08 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 122.534 2.156 . . . . 0.0 113.281 172.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.97 -41.17 10.16 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.586 1.154 . . . . 0.0 113.974 -174.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 49.57 -117.41 0.99 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.216 1.807 . . . . 0.0 112.488 178.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -102.65 9.31 39.35 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.401 1.48 . . . . 0.0 113.8 -175.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.76 124.55 23.61 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.259 -0.9 . . . . 0.0 112.376 -177.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 60.12 163.93 0.06 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 127.327 2.251 . . . . 0.0 115.173 -175.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -69.99 136.84 50.88 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.11 -0.994 . . . . 0.0 110.958 172.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.3 mp -73.92 151.81 40.29 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.156 0.983 . . . . 0.0 112.097 179.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.422 ' CE1' ' HE ' ' A' ' 91' ' ' ARG . 5.7 p80 -151.09 147.32 26.93 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.746 1.618 . . . . 0.0 111.439 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.57 34.76 0.59 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.04 1.336 . . . . 0.0 113.145 -176.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.422 ' HE ' ' CE1' ' A' ' 89' ' ' HIS . 37.2 ttm-85 -62.24 -15.69 48.69 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 127.045 2.138 . . . . 0.0 115.021 -171.18 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.7 pt -70.2 -13.58 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.932 1.693 . . . . 0.0 113.817 173.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -63.52 148.37 48.91 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.146 0.978 . . . . 0.0 113.054 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.2 t -158.83 150.93 21.23 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.989 1.316 . . . . 0.0 111.903 177.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.7 m -75.32 -13.75 60.44 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.539 1.135 . . . . 0.0 113.363 169.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 86.3 p -72.25 161.76 30.41 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.615 1.166 . . . . 0.0 113.437 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -150.56 156.12 40.77 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.553 1.541 . . . . 0.0 111.461 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -140.07 11.06 2.39 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.991 1.316 . . . . 0.0 114.151 -176.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -151.51 155.79 39.23 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.377 1.471 . . . . 0.0 112.193 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -130.13 26.31 5.18 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 126.107 1.763 . . . . 0.0 112.724 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.6 mt -79.58 -5.52 55.13 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.631 1.572 . . . . 0.0 114.751 -171.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -63.22 137.21 58.13 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.23 1.012 . . . . 0.0 112.789 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.48 147.13 46.36 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.951 0.901 . . . . 0.0 112.706 179.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -116.89 9.2 13.74 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.484 1.514 . . . . 0.0 113.374 -179.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -67.34 136.22 54.49 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.128 1.371 . . . . 0.0 112.154 -176.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -84.42 147.28 27.2 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.54 1.136 . . . . 0.0 111.721 173.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.6 mp -103.73 -18.46 14.68 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.626 1.57 . . . . 0.0 112.787 174.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -77.7 169.1 18.88 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.526 1.13 . . . . 0.0 112.95 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.9 t -148.64 146.64 28.28 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.21 1.404 . . . . 0.0 111.92 176.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.6 -3.18 52.66 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.944 1.298 . . . . 0.0 113.943 173.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 23.7 t -65.83 136.25 55.92 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.012 0.925 . . . . 0.0 112.341 -179.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -76.66 153.27 35.34 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.009 1.324 . . . . 0.0 112.738 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.9 t0 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 126.018 1.727 . . . . 0.0 112.814 175.285 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.638 0 N-CA-C 111.948 -0.461 . . . . 0.0 111.948 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.1 mtp -70.41 155.99 92.58 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.117 0.967 . . . . 0.0 112.526 177.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -53.36 121.71 9.93 Favored 'Trans proline' 0 CA--C 1.549 1.241 0 C-N-CA 124.092 3.195 . . . . 0.0 112.923 175.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -67.87 145.76 69.59 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 122.606 2.204 . . . . 0.0 113.878 -175.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -65.71 146.98 85.36 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 122.991 2.46 . . . . 0.0 112.206 176.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 60.16 0.7 0.3 Allowed 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 117.234 2.309 . . . . 0.0 117.234 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -92.25 14.36 16.5 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.677 1.591 . . . . 0.0 112.693 169.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.0 mt -129.15 136.74 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.587 1.555 . . . . 0.0 110.15 -170.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 10.3 m -129.79 127.47 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.19 1.396 . . . . 0.0 111.594 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -75.83 141.56 42.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.006 0.922 . . . . 0.0 111.03 175.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 34.2 m -140.68 156.83 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.498 1.519 . . . . 0.0 111.936 -176.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -117.28 116.24 26.84 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.789 1.235 . . . . 0.0 109.945 170.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.2 mt -103.71 126.1 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 124.303 1.041 . . . . 0.0 110.568 -171.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -84.56 146.92 27.29 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.262 1.425 . . . . 0.0 113.147 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -153.34 142.18 14.43 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 125.941 1.696 . . . . 0.0 110.167 169.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -62.07 138.67 74.33 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.66 2.24 . . . . 0.0 113.592 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.73 13.21 71.58 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.355 0.902 . . . . 0.0 115.355 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.8 154.22 50.6 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.263 1.425 . . . . 0.0 112.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -68.56 148.35 98.1 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 123.522 0.729 . . . . 0.0 111.059 170.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.34 129.91 33.5 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 122.548 2.165 . . . . 0.0 113.064 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -81.08 111.62 17.7 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.64 1.176 . . . . 0.0 110.347 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.8 mt -77.03 127.51 32.81 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.328 0.651 . . . . 0.0 109.651 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.7 ptm -154.86 178.18 10.45 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.014 0.925 . . . . 0.0 111.833 173.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -115.8 136.44 53.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.453 1.101 . . . . 0.0 111.924 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.0 mt -105.1 107.43 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 125.794 1.637 . . . . 0.0 108.225 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -78.34 117.04 19.2 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 168.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -67.07 -13.39 61.88 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -87.36 -21.96 25.35 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.188 0.995 . . . . 0.0 113.681 173.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -75.99 148.35 81.49 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 124.469 1.108 . . . . 0.0 111.852 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.02 139.34 42.53 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.978 2.452 . . . . 0.0 111.04 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.4 mt -61.44 -31.13 71.07 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.35 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.7 t -60.02 -44.51 94.56 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.56 1.073 . . . . 0.0 112.291 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -39.84 93.5 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.659 -0.651 . . . . 0.0 112.026 175.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.5 mt -65.03 -46.49 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.166 0.586 . . . . 0.0 110.619 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.1 mt -60.26 -38.2 76.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.658 1.183 . . . . 0.0 111.138 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -61.69 -40.15 93.97 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.4 0.68 . . . . 0.0 112.316 172.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -69.31 -25.66 64.34 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.396 1.078 . . . . 0.0 113.167 173.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.35 -58.99 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.438 1.017 . . . . 0.0 110.564 169.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.3 p -65.08 -35.05 79.92 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.238 0.615 . . . . 0.0 112.348 -169.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -60.53 -29.0 68.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.055 0.942 . . . . 0.0 112.922 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -64.62 -22.98 68.47 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.421 1.01 . . . . 0.0 114.263 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -115.48 10.71 15.78 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.022 1.729 . . . . 0.0 113.053 172.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.1 t 54.96 31.1 15.29 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.049 1.74 . . . . 0.0 114.169 -175.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.41 125.42 29.51 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.707 1.203 . . . . 0.0 109.908 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.83 159.23 30.24 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 113.586 -175.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 51.6 75.78 0.19 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 127.081 2.153 . . . . 0.0 113.325 170.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -62.33 -17.82 59.81 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.485 1.114 . . . . 0.0 113.661 -173.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -55.31 -30.88 61.07 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.224 1.41 . . . . 0.0 112.68 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -73.55 -23.49 59.98 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.155 0.582 . . . . 0.0 112.22 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -94.85 158.03 15.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.801 1.24 . . . . 0.0 114.331 -169.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.71 148.41 35.66 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.731 2.013 . . . . 0.0 109.748 169.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.29 148.33 35.76 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 167.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -141.39 153.99 45.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.344 1.458 . . . . 0.0 109.375 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -68.72 148.47 50.33 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.314 -0.866 . . . . 0.0 112.427 171.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.22 -25.56 4.84 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.317 1.447 . . . . 0.0 111.265 167.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -62.92 -49.76 73.5 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.617 0.767 . . . . 0.0 109.227 167.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.9 t -88.58 155.24 19.74 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.523 1.129 . . . . 0.0 109.161 165.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.0 m -60.59 -48.94 79.56 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 -168.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -155.06 13.7 0.39 Allowed 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 116.362 1.986 . . . . 0.0 116.362 -169.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.2 m-30 -66.27 118.29 9.75 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 120.084 1.311 . . . . 0.0 111.476 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -70.89 145.83 49.96 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.421 -0.799 . . . . 0.0 111.553 172.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.1 mm -84.82 131.15 34.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.096 0.958 . . . . 0.0 110.238 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 29.9 p -146.9 169.48 19.07 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.155 1.782 . . . . 0.0 110.102 -176.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -60.03 -18.0 43.03 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.734 -1.229 . . . . 0.0 113.458 172.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -96.0 -8.06 34.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.988 1.715 . . . . 0.0 114.296 175.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -133.69 -13.28 2.58 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 -172.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -59.95 -23.31 63.46 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 120.581 -1.324 . . . . 0.0 114.105 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -61.78 -22.69 65.65 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.394 1.478 . . . . 0.0 113.279 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -73.75 -19.55 60.75 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.641 0.777 . . . . 0.0 112.863 177.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 51.3 mt -68.76 132.71 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.97 0.908 . . . . 0.0 109.603 174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -135.48 165.51 25.34 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.651 1.98 . . . . 0.0 111.882 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -57.62 116.04 3.15 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.332 0.653 . . . . 0.0 111.362 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.15 11.58 56.03 Favored Glycine 0 CA--C 1.539 1.535 0 C-N-CA 125.59 1.567 . . . . 0.0 115.568 -176.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 98.9 m -65.85 133.12 50.28 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.606 1.703 . . . . 0.0 111.781 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.3 mt -85.19 121.97 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 170.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -118.7 -179.89 3.94 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.734 2.013 . . . . 0.0 110.873 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -148.55 137.45 21.6 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 127.331 2.252 . . . . 0.0 110.256 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 tp -85.27 137.88 32.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.754 0.821 . . . . 0.0 109.993 169.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.2 t -157.19 151.86 25.5 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.812 0.845 . . . . 0.0 110.917 -178.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.3 p -71.03 132.63 45.43 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.988 -1.07 . . . . 0.0 110.298 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.9 p -68.47 162.29 63.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.462 1.505 . . . . 0.0 114.199 -169.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -63.86 -28.59 67.51 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.551 2.167 . . . . 0.0 112.609 168.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.74 -37.96 70.5 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.195 1.398 . . . . 0.0 114.118 -173.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -66.04 -11.43 48.29 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 -176.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -68.67 -11.76 60.56 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.227 1.011 . . . . 0.0 113.501 170.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -139.36 -176.56 4.57 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.336 1.855 . . . . 0.0 111.767 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -71.86 8.95 1.02 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 126.003 1.721 . . . . 0.0 114.363 179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -77.3 46.16 0.5 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.676 1.99 . . . . 0.0 113.339 -176.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.4 mp -67.99 149.72 49.37 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.971 1.308 . . . . 0.0 111.432 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -73.0 153.04 41.09 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.512 1.125 . . . . 0.0 113.522 -174.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -152.22 157.5 41.54 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.509 1.524 . . . . 0.0 110.408 169.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -79.33 67.91 5.19 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.511 1.124 . . . . 0.0 112.754 -173.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.8 mm -62.63 140.7 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.72 1.208 . . . . 0.0 110.02 169.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 33.1 tp60 -62.89 131.13 47.72 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.593 0.757 . . . . 0.0 111.964 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.1 t -154.78 154.76 33.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.676 1.59 . . . . 0.0 110.77 178.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 99.0 p -152.28 160.97 43.25 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.088 1.355 . . . . 0.0 112.111 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.4 t -153.73 138.68 17.22 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.866 1.266 . . . . 0.0 111.225 -177.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 51.3 tpp -81.17 148.51 29.52 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.683 1.193 . . . . 0.0 111.953 175.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -66.79 149.2 50.89 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.983 0.913 . . . . 0.0 112.218 175.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -126.73 28.85 5.8 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.542 1.537 . . . . 0.0 112.542 -176.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -54.38 123.11 11.95 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.836 1.654 . . . . 0.0 111.83 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 61.4 tp -157.69 140.86 15.26 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.702 1.601 . . . . 0.0 110.585 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -69.93 131.08 43.87 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.5 0.72 . . . . 0.0 111.38 174.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -153.52 156.9 38.94 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.518 1.127 . . . . 0.0 112.792 -174.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.2 mt -137.67 160.39 39.34 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.439 1.895 . . . . 0.0 111.18 178.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -144.22 143.48 31.07 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.76 1.624 . . . . 0.0 110.835 178.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 20.1 p-10 -83.02 75.77 9.88 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.879 1.672 . . . . 0.0 111.546 174.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.41 153.83 30.11 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.003 0.921 . . . . 0.0 111.985 175.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.88 -22.07 63.92 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.2 p -64.4 -18.53 64.79 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.274 1.43 . . . . 0.0 114.182 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.97 -20.14 59.79 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.861 0.864 . . . . 0.0 112.665 172.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 24.1 t -66.85 132.95 49.07 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.794 0.838 . . . . 0.0 111.512 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -159.06 157.26 30.77 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.464 1.505 . . . . 0.0 112.658 -169.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.088 1.755 . . . . 0.0 113.15 175.892 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.559 0 N-CA-C 111.975 -0.45 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt 51.35 66.99 4.63 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.369 1.868 . . . . 0.0 113.862 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -67.88 166.23 25.26 Favored 'Trans proline' 0 CA--C 1.548 1.194 0 C-N-CA 123.475 2.783 . . . . 0.0 112.75 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -58.5 158.51 23.03 Favored 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 123.632 2.888 . . . . 0.0 113.855 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -56.72 136.78 78.17 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.68 2.92 . . . . 0.0 114.222 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -80.27 74.81 7.08 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.901 1.28 . . . . 0.0 111.751 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -73.43 33.86 0.08 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 125.993 1.717 . . . . 0.0 114.282 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.5 mt -81.16 138.81 19.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 125.673 1.589 . . . . 0.0 109.746 176.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 m -129.44 132.17 66.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.937 1.295 . . . . 0.0 112.01 -177.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -69.15 146.42 52.49 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.761 0.824 . . . . 0.0 110.756 170.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.5 m -143.69 151.58 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.408 1.483 . . . . 0.0 111.521 176.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.87 116.75 28.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.665 1.186 . . . . 0.0 109.854 173.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 33.7 mt -106.7 123.96 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.907 0.883 . . . . 0.0 110.823 -169.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -82.7 144.69 30.06 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.236 1.414 . . . . 0.0 112.933 174.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.4 t-105 -154.83 143.44 14.67 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 126.003 1.721 . . . . 0.0 110.079 169.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -63.02 143.21 90.46 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.605 2.203 . . . . 0.0 113.789 -173.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.5 12.27 73.2 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 115.432 0.933 . . . . 0.0 115.432 178.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -141.91 155.79 45.5 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.181 1.392 . . . . 0.0 112.702 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -69.47 152.86 96.23 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 123.803 0.841 . . . . 0.0 111.371 169.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.99 128.9 29.52 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 122.596 2.198 . . . . 0.0 113.17 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -78.29 111.32 14.14 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.623 1.169 . . . . 0.0 110.148 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.6 mt -77.3 127.67 32.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.316 0.646 . . . . 0.0 109.584 169.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 24.4 ptm -152.63 -178.52 6.91 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.035 0.934 . . . . 0.0 111.67 172.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -122.44 129.64 52.26 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.49 1.116 . . . . 0.0 111.572 178.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.2 mt -96.26 112.87 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 C-N-CA 125.311 1.444 . . . . 0.0 108.664 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -83.99 120.47 26.15 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 167.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -64.92 -11.09 34.28 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.761 1.022 . . . . 0.0 113.761 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -87.22 -21.9 25.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.944 1.298 . . . . 0.0 114.345 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -77.97 141.87 63.88 Favored Pre-proline 0 N--CA 1.483 1.191 0 CA-C-N 119.831 1.196 . . . . 0.0 111.513 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.19 144.22 56.32 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.333 2.688 . . . . 0.0 111.543 177.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.1 mt -63.72 -29.97 71.13 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.071 -0.966 . . . . 0.0 113.097 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.0 t -61.13 -44.82 96.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 120.397 1.453 . . . . 0.0 111.898 174.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.11 95.52 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.567 -0.708 . . . . 0.0 112.194 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 78.8 mt -63.12 -50.41 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.399 0.679 . . . . 0.0 110.502 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.3 mt -62.01 -35.66 69.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.299 1.04 . . . . 0.0 110.946 -179.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -60.02 -43.33 95.34 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.041 0.837 . . . . 0.0 112.081 170.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -68.74 -29.69 68.16 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.732 1.213 . . . . 0.0 113.121 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.16 -53.66 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 121.292 -0.88 . . . . 0.0 110.155 169.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 99.0 m -61.4 -43.73 98.37 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.161 0.984 . . . . 0.0 111.986 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -60.34 -29.72 69.07 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.098 0.959 . . . . 0.0 112.847 175.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.32 -23.58 62.45 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.395 0.998 . . . . 0.0 114.436 173.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 5.4 m-90 -117.71 16.86 14.45 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.97 1.708 . . . . 0.0 113.25 171.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.0 p 56.33 21.02 5.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.281 2.232 . . . . 0.0 115.536 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -68.41 123.92 22.1 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.447 1.499 . . . . 0.0 111.423 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.89 158.73 31.72 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.445 1.098 . . . . 0.0 112.365 175.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 50.52 68.41 0.77 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.491 1.916 . . . . 0.0 112.998 173.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -62.2 -15.72 48.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.558 1.143 . . . . 0.0 113.158 -177.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -55.99 -26.92 50.59 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.754 1.622 . . . . 0.0 113.197 176.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -77.77 -15.9 58.77 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -98.18 157.65 16.03 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -168.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.65 149.24 35.35 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 127.297 2.239 . . . . 0.0 109.53 169.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -78.39 157.16 29.14 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -145.85 147.82 32.22 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.792 1.237 . . . . 0.0 110.157 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -65.19 125.98 26.69 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.629 -0.669 . . . . 0.0 110.906 173.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.79 -27.41 50.16 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -171.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -77.89 69.69 4.16 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.085 1.354 . . . . 0.0 112.811 -170.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.5 p 60.22 -14.81 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 129.294 3.038 . . . . 0.0 117.198 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.4 t -66.72 148.28 52.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.514 1.526 . . . . 0.0 113.282 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.2 p-10 -87.01 -5.54 59.04 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.432 1.093 . . . . 0.0 113.608 170.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -63.55 107.1 1.06 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.511 1.051 . . . . 0.0 112.861 -169.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -70.05 146.35 51.04 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.755 0.822 . . . . 0.0 110.005 168.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 36.1 mm -80.6 136.64 22.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.115 0.966 . . . . 0.0 110.083 175.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.0 p -144.43 169.51 17.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 127.236 2.214 . . . . 0.0 108.553 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -62.19 -11.78 16.41 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 177.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.76 -44.97 6.85 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.352 1.461 . . . . 0.0 112.509 168.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -76.25 -21.64 56.11 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.486 1.114 . . . . 0.0 113.509 -172.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -57.15 -22.23 38.63 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 176.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -66.86 -18.51 65.41 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.401 1.081 . . . . 0.0 113.377 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -79.83 -11.26 59.83 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.288 1.035 . . . . 0.0 113.452 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.4 mt -76.14 133.03 31.99 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 124.311 1.044 . . . . 0.0 109.651 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.75 166.89 15.39 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 126.724 2.01 . . . . 0.0 111.804 173.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -60.65 118.89 7.13 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.823 -0.548 . . . . 0.0 111.41 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 92.16 14.34 56.17 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 125.293 1.425 . . . . 0.0 115.436 -175.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -65.33 130.62 43.98 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.77 1.785 . . . . 0.0 111.28 177.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mt -84.29 121.92 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 170.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -117.88 174.62 6.08 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.255 1.822 . . . . 0.0 110.671 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -141.92 133.84 27.33 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 126.239 1.816 . . . . 0.0 109.976 178.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 tp -79.47 136.8 37.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.194 0.598 . . . . 0.0 110.138 170.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.3 t -157.53 151.0 23.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.421 1.088 . . . . 0.0 110.11 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.9 p -72.0 138.57 48.06 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 120.493 -1.38 . . . . 0.0 110.388 169.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p -65.93 162.23 47.45 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 123.954 0.902 . . . . 0.0 112.234 -175.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -56.49 -24.38 52.67 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.302 2.668 . . . . 0.0 115.053 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -104.08 -4.93 22.6 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.546 1.538 . . . . 0.0 114.173 176.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 49.91 38.04 15.16 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.873 1.669 . . . . 0.0 112.789 -168.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -148.61 164.85 33.03 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 127.639 2.376 . . . . 0.0 110.242 -177.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.55 -34.14 75.06 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -176.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -80.23 111.04 16.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.075 0.95 . . . . 0.0 109.334 168.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.3 pm0 -73.92 -19.91 60.54 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.9 135.52 33.28 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.236 1.414 . . . . 0.0 112.952 -177.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 27.2 p80 -84.48 -10.27 57.62 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.799 1.24 . . . . 0.0 113.513 169.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -65.5 145.5 56.03 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.177 1.391 . . . . 0.0 113.175 -177.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -135.38 136.17 41.24 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.13 1.772 . . . . 0.0 111.231 -178.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 99.5 mt -77.55 -46.11 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.126 0.971 . . . . 0.0 111.619 -176.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -151.99 149.38 28.82 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.648 1.179 . . . . 0.0 112.705 -177.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 87.7 p -75.03 171.74 13.57 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.611 1.564 . . . . 0.0 113.195 175.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.6 t -145.43 156.47 43.77 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.642 1.577 . . . . 0.0 111.052 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 80.1 p -67.76 -31.25 71.03 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.185 0.994 . . . . 0.0 113.124 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 78.1 mtm -147.28 108.72 4.3 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.633 1.573 . . . . 0.0 111.27 176.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -76.45 -32.78 58.62 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.276 0.63 . . . . 0.0 112.119 169.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.43 60.77 2.68 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.823 1.649 . . . . 0.0 112.285 178.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -58.19 -25.03 61.08 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.224 1.41 . . . . 0.0 114.364 -176.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -76.1 -10.22 59.24 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.373 1.869 . . . . 0.0 115.048 176.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -68.2 142.04 55.8 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.314 0.961 . . . . 0.0 112.913 -177.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -148.63 164.16 35.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.737 1.615 . . . . 0.0 111.719 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -148.72 159.97 43.62 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.568 1.547 . . . . 0.0 112.088 -177.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -71.57 155.19 40.83 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.796 1.239 . . . . 0.0 112.53 178.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -69.18 157.24 37.28 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.241 1.016 . . . . 0.0 112.378 171.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 4.6 pp -147.69 166.96 25.88 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.34 1.456 . . . . 0.0 112.191 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -148.03 166.66 27.08 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.67 1.588 . . . . 0.0 111.888 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.3 t -148.39 160.24 43.22 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.779 1.231 . . . . 0.0 112.572 -177.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.4 mt -76.13 -5.57 47.23 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.257 1.423 . . . . 0.0 113.405 173.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 91.5 p -69.56 -14.56 62.91 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.197 1.399 . . . . 0.0 114.554 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -64.52 150.07 47.43 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.665 1.586 . . . . 0.0 112.628 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.0 t0 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 125.899 1.679 . . . . 0.0 112.906 176.077 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.604 0 N-CA-C 112.066 -0.414 . . . . 0.0 112.066 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.0 ptm -66.26 151.25 96.08 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 124.095 0.958 . . . . 0.0 112.774 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.73 153.05 76.95 Favored 'Trans proline' 0 CA--C 1.546 1.122 0 C-N-CA 122.906 2.404 . . . . 0.0 112.206 173.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -70.29 155.74 63.5 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.371 2.714 . . . . 0.0 112.648 177.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -69.15 162.19 42.76 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.596 2.864 . . . . 0.0 112.462 173.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -146.69 153.59 40.45 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.129 1.371 . . . . 0.0 112.077 177.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 51.2 p-10 -106.11 9.32 32.38 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.09 1.756 . . . . 0.0 114.037 -177.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.1 mt -71.04 137.32 24.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.95 1.3 . . . . 0.0 109.243 174.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 m -129.02 123.3 58.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.484 1.114 . . . . 0.0 112.745 -173.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -72.86 137.72 45.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.37 1.468 . . . . 0.0 111.261 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.7 m -139.34 157.01 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.511 1.524 . . . . 0.0 111.956 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.54 118.47 32.73 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.817 1.247 . . . . 0.0 109.837 171.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.5 mt -106.03 123.97 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.805 0.842 . . . . 0.0 110.882 -171.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -85.53 143.57 28.43 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.062 1.745 . . . . 0.0 113.025 176.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -156.46 142.09 12.7 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.086 1.754 . . . . 0.0 110.1 169.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -59.12 145.88 96.25 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.999 2.466 . . . . 0.0 114.493 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.1 11.46 74.89 Favored Glycine 0 CA--C 1.539 1.56 0 N-CA-C 115.607 1.003 . . . . 0.0 115.607 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -144.72 158.6 43.72 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.104 1.361 . . . . 0.0 112.695 -177.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -70.65 155.42 93.42 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.012 0.925 . . . . 0.0 111.662 170.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -60.65 130.18 32.31 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.653 2.235 . . . . 0.0 112.732 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -82.74 108.74 16.33 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.354 1.061 . . . . 0.0 110.453 176.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.7 mt -76.4 128.03 34.03 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 110.17 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -155.3 175.37 13.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.411 1.084 . . . . 0.0 111.638 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -122.71 118.32 27.81 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.383 1.073 . . . . 0.0 111.584 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.8 mt -83.79 110.54 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 125.227 1.411 . . . . 0.0 108.848 175.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -81.95 116.48 21.6 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 169.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.68 -12.71 55.92 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.0 -26.63 26.97 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.35 0.977 . . . . 0.0 113.489 171.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -77.45 142.48 67.06 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.02 0.928 . . . . 0.0 111.396 177.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.22 143.15 63.48 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.12 2.547 . . . . 0.0 111.296 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.2 mt -60.69 -31.39 70.64 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.442 178.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.8 p -59.18 -45.4 91.12 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.597 1.09 . . . . 0.0 112.45 174.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.77 89.48 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.178 0.591 . . . . 0.0 112.109 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.73 -47.54 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.647 0.779 . . . . 0.0 110.843 177.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.52 -37.73 78.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 124.589 1.156 . . . . 0.0 110.761 178.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -62.93 -38.47 91.16 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.727 0.639 . . . . 0.0 112.727 172.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -71.02 -23.94 62.27 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.262 1.025 . . . . 0.0 113.074 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 73.2 t -73.14 -62.32 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 O-C-N 121.107 -0.996 . . . . 0.0 111.005 169.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 16.8 p -59.74 -30.98 69.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.94 1.296 . . . . 0.0 113.652 -169.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -59.85 -28.38 67.47 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.573 1.149 . . . . 0.0 113.346 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.68 -26.08 74.83 Favored Glycine 0 CA--C 1.534 1.232 0 O-C-N 121.332 -0.855 . . . . 0.0 114.011 177.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 7.0 m0 -107.67 11.09 28.77 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.668 1.587 . . . . 0.0 112.84 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.8 m 55.41 29.23 12.77 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.157 1.783 . . . . 0.0 114.065 -176.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.5 mt -80.51 121.01 25.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.602 1.161 . . . . 0.0 110.332 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.7 165.85 23.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.78 1.232 . . . . 0.0 113.214 -178.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 54.15 63.75 2.07 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.037 1.735 . . . . 0.0 113.417 173.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -59.77 -21.8 61.26 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.958 0.903 . . . . 0.0 113.35 -176.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -55.95 -28.92 59.14 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.211 1.405 . . . . 0.0 113.127 172.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -77.77 -16.81 58.12 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.785 0.834 . . . . 0.0 112.624 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -96.99 159.64 14.79 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -169.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.27 156.35 43.31 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.152 2.581 . . . . 0.0 109.78 171.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 31.0 mt -89.5 156.02 18.91 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 166.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -148.25 147.34 29.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.979 0.912 . . . . 0.0 110.998 -177.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 52.2 m-70 -65.9 130.53 43.58 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.336 0.654 . . . . 0.0 112.036 174.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.75 2.55 50.91 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.321 1.048 . . . . 0.0 113.198 169.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -65.89 179.96 0.81 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.656 1.982 . . . . 0.0 112.842 176.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -58.09 -11.58 2.67 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.017 1.727 . . . . 0.0 115.269 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.0 t -136.57 129.17 30.45 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.241 1.416 . . . . 0.0 110.164 168.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 29.5 m120 -90.51 60.15 4.52 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.246 1.418 . . . . 0.0 112.59 -169.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -64.32 134.38 54.54 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.434 -0.791 . . . . 0.0 111.164 172.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -71.77 145.92 48.41 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 121.682 -0.636 . . . . 0.0 110.93 169.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.3 mm -82.14 130.22 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 123.988 0.915 . . . . 0.0 109.545 173.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.5 p -143.69 166.77 23.94 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.786 1.634 . . . . 0.0 109.78 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.57 -13.16 27.97 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.853 -1.154 . . . . 0.0 113.345 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -97.91 -13.59 21.12 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.123 1.769 . . . . 0.0 114.417 173.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -126.3 -11.74 6.31 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -60.74 -18.88 57.38 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -62.4 -22.13 65.91 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.807 1.243 . . . . 0.0 113.112 174.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -75.02 -13.15 60.47 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.062 0.945 . . . . 0.0 113.357 177.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 65.3 mt -73.37 134.48 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.321 1.049 . . . . 0.0 110.079 175.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -126.85 166.38 17.57 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 126.227 1.811 . . . . 0.0 111.442 174.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -56.92 125.09 20.96 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.761 -0.587 . . . . 0.0 111.321 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.7 9.29 68.89 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.238 1.399 . . . . 0.0 115.343 -176.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 99.0 m -66.0 130.07 41.99 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 119.498 1.649 . . . . 0.0 111.255 177.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.8 mt -87.0 124.77 40.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 170.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.4 mt -118.21 172.46 7.42 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.239 1.815 . . . . 0.0 110.723 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.7 ttt-85 -132.11 140.38 48.79 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 126.745 2.018 . . . . 0.0 110.049 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.96 140.19 38.07 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 167.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.3 t -158.25 152.84 24.69 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.308 -0.87 . . . . 0.0 111.028 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.1 p -73.6 135.15 43.83 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.568 -1.332 . . . . 0.0 110.856 170.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.3 t -71.46 145.71 90.68 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 126.434 1.893 . . . . 0.0 114.421 -168.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.23 -16.94 53.57 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.592 2.194 . . . . 0.0 112.665 168.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.28 12.88 14.82 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.787 1.635 . . . . 0.0 114.733 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -57.26 152.32 14.17 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.054 -1.029 . . . . 0.0 112.873 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -143.21 138.29 29.58 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.527 1.531 . . . . 0.0 110.652 -177.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.19 -14.86 61.44 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.707 1.203 . . . . 0.0 114.115 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -58.3 132.02 52.37 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.9 1.28 . . . . 0.0 112.252 177.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -72.36 142.25 48.77 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.099 0.96 . . . . 0.0 111.685 174.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.9 mt -130.81 165.99 21.8 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.251 1.821 . . . . 0.0 112.003 -174.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 35.6 p80 -143.4 163.07 34.08 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.679 1.592 . . . . 0.0 111.732 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -154.1 168.11 27.58 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.946 1.298 . . . . 0.0 112.608 -175.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -138.06 138.18 38.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.376 1.87 . . . . 0.0 110.371 173.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 99.0 mt -72.33 124.94 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.993 0.917 . . . . 0.0 110.227 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 66.8 tp60 -79.96 130.5 35.33 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.428 1.091 . . . . 0.0 111.286 174.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 34.5 t -72.94 135.27 45.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.517 0.727 . . . . 0.0 111.363 171.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 25.4 t -159.94 152.47 21.1 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.926 1.29 . . . . 0.0 111.81 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.0 m -142.89 139.96 31.01 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.677 1.591 . . . . 0.0 111.097 177.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 27.9 ptm -158.35 172.66 17.96 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.287 1.435 . . . . 0.0 112.034 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 56.2 p30 -135.33 164.98 26.52 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.87 1.668 . . . . 0.0 111.74 170.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -154.6 166.13 34.33 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.075 1.35 . . . . 0.0 112.365 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -62.77 146.11 53.27 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.866 1.267 . . . . 0.0 111.518 173.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.4 mt -64.73 148.28 51.44 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.355 1.062 . . . . 0.0 112.672 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -72.36 158.58 35.52 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.579 1.152 . . . . 0.0 113.703 177.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -142.61 160.92 39.36 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.273 1.829 . . . . 0.0 111.006 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.82 137.07 57.55 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.856 0.862 . . . . 0.0 112.336 -177.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -90.72 -8.08 50.81 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.921 1.288 . . . . 0.0 113.863 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -75.3 -8.79 57.6 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.269 1.428 . . . . 0.0 114.691 -172.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -77.49 46.88 0.55 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.109 1.764 . . . . 0.0 112.971 -175.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -77.76 -7.36 56.45 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.78 1.632 . . . . 0.0 114.2 175.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.8 m 64.53 160.64 0.11 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 127.448 2.299 . . . . 0.0 115.111 -173.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 57.0 tp -67.74 141.7 56.51 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.772 1.229 . . . . 0.0 112.021 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 56.7 p -62.13 146.08 51.55 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.711 1.204 . . . . 0.0 112.8 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -116.7 7.09 13.41 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.95 1.7 . . . . 0.0 114.03 -176.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 . . . . . 0 C--O 1.251 1.173 0 C-N-CA 125.58 1.552 . . . . 0.0 113.562 177.85 . . . . . . . . 0 0 . 1 stop_ save_