data_2knq_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2knq _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 6' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 N--CA 1.471 0.607 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.51 -39.95 81.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.052 1.296 . . . . 0.0 114.493 -169.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 t -65.6 -49.2 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.869 0.868 . . . . 0.0 110.492 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.13 -38.73 88.88 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.572 0.749 . . . . 0.0 112.418 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -62.25 -41.77 98.73 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.095 0.958 . . . . 0.0 111.224 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.5 m -63.48 -48.24 78.48 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.799 -0.563 . . . . 0.0 111.619 173.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.5 mmt-85 -61.69 -32.15 72.33 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.403 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.92 76.75 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.675 1.58 . . . . 0.0 111.848 173.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.0 mtm105 -62.2 -41.15 98.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.641 0.776 . . . . 0.0 111.73 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.11 -49.4 77.45 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -35.66 76.31 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.215 1.006 . . . . 0.0 111.484 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.18 88.11 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.57 97.82 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.084 0.856 . . . . 0.0 111.86 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.0 mtt85 -62.19 -45.57 92.78 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.63 1.172 . . . . 0.0 111.707 176.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -60.78 -44.28 97.0 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.623 0.769 . . . . 0.0 112.653 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.8 m -60.55 -43.42 97.24 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.912 0.778 . . . . 0.0 110.78 178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.83 97.07 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.975 -1.078 . . . . 0.0 113.276 172.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -32.18 73.66 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.275 -0.89 . . . . 0.0 113.115 175.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.3 tp -73.56 -33.72 64.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.204 1.401 . . . . 0.0 111.786 172.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.82 -45.33 93.13 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.892 -1.13 . . . . 0.0 110.704 169.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 tp -52.2 -46.39 65.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.439 1.496 . . . . 0.0 111.324 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.64 96.92 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.81 -45.42 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.708 0.803 . . . . 0.0 110.689 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.06 -35.74 79.56 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.675 0.79 . . . . 0.0 112.815 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.338 1.055 . . . . 0.0 113.164 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.14 -37.88 88.97 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -177.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -70.01 -28.55 65.59 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 121.527 -0.733 . . . . 0.0 112.504 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.3 mt -80.72 -31.99 35.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.081 1.352 . . . . 0.0 112.971 178.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.4 m -82.21 -20.23 38.17 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -170.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.75 3.4 79.46 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -143.03 149.12 47.99 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.127 2.571 . . . . 0.0 107.175 172.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -45.54 143.51 5.89 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.647 2.231 . . . . 0.0 111.807 168.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 25.6 t -88.14 162.5 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.587 1.155 . . . . 0.0 108.716 173.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.93 176.63 23.13 Favored Glycine 0 N--CA 1.46 0.282 0 O-C-N 121.261 -0.9 . . . . 0.0 113.567 173.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.5 mt -137.3 117.18 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.672 1.189 . . . . 0.0 108.813 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -74.77 146.87 41.77 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.239 1.816 . . . . 0.0 110.473 170.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -145.17 133.99 22.36 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.403 1.481 . . . . 0.0 110.351 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -150.74 27.17 0.72 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.057 1.343 . . . . 0.0 113.442 -173.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.8 t0 63.08 -66.97 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 128.242 2.617 . . . . 0.0 113.867 -176.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 75.2 m -66.54 -24.34 66.36 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.909 0.884 . . . . 0.0 113.162 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.05 169.79 21.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.559 1.144 . . . . 0.0 112.048 174.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.5 p90 -153.98 164.41 38.47 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.596 2.758 . . . . 0.0 107.469 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -167.09 146.8 5.37 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.615 1.098 . . . . 0.0 112.713 172.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mm -66.29 152.89 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.473 0.709 . . . . 0.0 109.175 170.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.1 mtp -142.94 151.29 40.79 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.635 1.574 . . . . 0.0 111.96 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.66 164.0 37.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.432 1.893 . . . . 0.0 111.521 -169.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -63.15 167.7 12.1 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.753 2.302 . . . . 0.0 113.47 171.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -156.98 163.27 32.21 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.888 1.709 . . . . 0.0 110.67 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm 59.05 -44.46 0.07 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 128.303 2.641 . . . . 0.0 115.885 -169.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.8 t -155.08 141.63 13.26 Favored Pre-proline 0 N--CA 1.472 0.656 0 C-N-CA 125.794 1.637 . . . . 0.0 111.797 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -79.8 -16.93 11.26 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 C-N-CA 123.188 2.592 . . . . 0.0 112.442 169.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.8 m -77.66 -7.03 55.83 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -169.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.38 151.62 36.81 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.014 1.325 . . . . 0.0 111.48 178.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.3 t-105 -52.69 112.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.946 1.699 . . . . 0.0 112.452 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -152.78 157.42 40.77 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.518 1.527 . . . . 0.0 110.221 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -143.15 143.7 31.91 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -174.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -145.41 139.71 15.21 Favored Pre-proline 0 N--CA 1.472 0.639 0 C-N-CA 128.73 2.812 . . . . 0.0 107.717 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.45 130.83 24.67 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.521 2.147 . . . . 0.0 111.635 174.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -79.3 78.08 5.8 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.796 0.839 . . . . 0.0 110.914 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -136.08 25.98 3.27 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.375 1.47 . . . . 0.0 112.133 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -58.71 -25.04 62.49 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 171.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -149.95 -26.8 0.25 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.108 1.363 . . . . 0.0 113.779 169.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.95 24.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 125.411 1.484 . . . . 0.0 114.193 169.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.36 121.15 8.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.562 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 55.13 22.84 4.84 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -173.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -119.32 -30.71 4.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.484 1.514 . . . . 0.0 110.686 169.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.9 t -67.9 -21.14 65.16 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.979 1.712 . . . . 0.0 112.308 169.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -137.4 152.79 50.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.217 1.407 . . . . 0.0 114.54 -169.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 46.95 -34.58 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.179 1 C-N-CA 131.974 4.11 . . . . 0.0 120.882 169.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.76 -15.62 63.02 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -169.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -68.43 -15.07 63.42 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -146.53 171.09 15.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.374 1.07 . . . . 0.0 113.696 -176.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -142.9 17.87 1.96 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.746 1.618 . . . . 0.0 112.582 172.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -144.53 0.59 1.01 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -168.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.8 mt -121.88 161.27 23.1 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -168.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.3 m -130.61 136.26 48.68 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.991 2.916 . . . . 0.0 106.685 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.93 141.53 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 125.01 1.324 . . . . 0.0 110.516 -169.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -139.08 153.42 48.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.52 1.528 . . . . 0.0 109.29 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.57 171.07 16.72 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 172.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.33 154.97 28.3 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 127.634 2.374 . . . . 0.0 109.707 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.94 -10.93 27.07 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 CA-C-N 121.368 1.524 . . . . 0.0 114.633 0.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -67.84 -171.43 0.21 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.27 1.428 . . . . 0.0 110.988 169.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.3 147.44 43.56 Favored Pre-proline 0 N--CA 1.479 0.976 0 O-C-N 120.787 -1.195 . . . . 0.0 112.82 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.1 105.23 1.15 Allowed 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.12 2.546 . . . . 0.0 109.543 174.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -160.98 137.87 8.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.885 1.274 . . . . 0.0 111.306 -169.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -69.78 46.6 0.07 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.355 2.662 . . . . 0.0 114.313 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.3 t -63.25 158.97 18.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.37 1.868 . . . . 0.0 114.159 -176.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -71.25 -5.09 29.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.974 1.31 . . . . 0.0 113.41 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -131.11 164.2 43.89 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 125.794 1.638 . . . . 0.0 111.321 176.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.02 162.12 36.78 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.45 2.1 . . . . 0.0 112.472 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -99.12 -12.22 20.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.12 1.368 . . . . 0.0 112.78 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.3 t -132.26 148.81 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 126.206 1.802 . . . . 0.0 109.398 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 73.0 t -135.49 143.09 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.77 1.228 . . . . 0.0 111.392 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -129.45 126.58 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 128.795 2.838 . . . . 0.0 109.91 -169.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.0 mt -83.98 159.81 21.16 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.123 0.963 . . . . 0.0 112.092 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.87 -26.58 67.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.2 1.4 . . . . 0.0 113.939 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -82.3 -8.6 59.64 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.651 1.58 . . . . 0.0 113.335 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.63 5.72 62.92 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.506 1.051 . . . . 0.0 114.735 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -72.01 138.83 48.23 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.507 1.154 . . . . 0.0 108.962 169.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 6.9 mm -128.05 132.9 68.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 124.558 1.143 . . . . 0.0 109.422 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.3 m -61.02 118.63 37.62 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.261 1.424 . . . . 0.0 110.431 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -52.07 132.7 44.16 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 124.017 3.144 . . . . 0.0 115.294 -176.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -162.72 174.66 12.22 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.525 1.93 . . . . 0.0 111.667 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.6 m -137.01 139.95 41.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.622 1.169 . . . . 0.0 109.463 169.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.2 tp -131.66 122.42 25.95 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.857 2.063 . . . . 0.0 109.01 -169.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.4 tt -118.78 144.58 46.2 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.265 1.826 . . . . 0.0 110.995 -169.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.1 mtt -123.54 128.3 49.55 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.093 1.357 . . . . 0.0 110.868 -176.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.16 139.13 54.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.071 1.349 . . . . 0.0 111.458 -178.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 42.5 t-20 -64.18 113.57 3.64 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.795 1.638 . . . . 0.0 110.893 -179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.59 -18.02 50.2 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -87.17 -17.23 59.49 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.721 1.153 . . . . 0.0 114.825 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.8 p -135.97 -28.74 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.171 1.485 . . . . 0.0 114.159 -169.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 89.64 -3.34 83.34 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.818 1.675 . . . . 0.0 113.885 -173.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -79.17 137.22 56.69 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 118.831 1.316 . . . . 0.0 112.496 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.96 142.4 42.55 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.898 2.399 . . . . 0.0 111.685 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.88 -35.18 5.2 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.717 0.807 . . . . 0.0 112.266 177.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.3 tp -155.74 151.55 27.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.257 1.023 . . . . 0.0 111.178 -168.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 75.6 m -139.83 152.83 46.83 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.506 1.122 . . . . 0.0 109.172 169.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.6 mt -124.66 142.53 51.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.681 2.392 . . . . 0.0 108.351 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 34.1 t -135.2 136.24 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.73 0.812 . . . . 0.0 111.969 -169.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 47.1 t -124.67 135.13 52.79 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.266 1.826 . . . . 0.0 110.919 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.1 m -131.09 7.65 4.67 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.384 1.074 . . . . 0.0 113.824 -176.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 144.73 -18.31 2.01 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.389 1.316 . . . . 0.0 116.389 172.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.3 t -157.36 155.79 31.2 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.786 1.793 . . . . 0.0 113.623 -172.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -58.59 141.8 83.75 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 115.589 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -93.18 178.34 11.88 Favored 'Cis proline' 0 CA--C 1.547 1.173 0 CA-C-N 119.757 0.949 . . . . 0.0 110.769 -11.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.89 155.77 38.65 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.107 -0.996 . . . . 0.0 111.801 169.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.07 119.81 37.36 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.231 1.412 . . . . 0.0 110.867 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -81.98 143.26 31.73 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.57 1.548 . . . . 0.0 111.323 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 3.4 t -142.75 145.01 32.87 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.013 1.325 . . . . 0.0 111.306 175.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.58 137.06 49.73 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 169.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 40.36 -97.98 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.125 1.77 . . . . 0.0 113.314 -169.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -135.35 22.18 3.43 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.524 1.53 . . . . 0.0 112.235 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.01 -21.44 21.4 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -169.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 1.2 t -120.8 11.97 11.24 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 73.91 71.34 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 125.117 1.367 . . . . 0.0 111.628 -170.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 C--O 1.251 1.132 0 C-N-CA 124.738 3.625 . . . . 0.0 114.685 175.358 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.627 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.34 -38.75 84.78 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.316 0.962 . . . . 0.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -63.86 -46.21 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.875 0.87 . . . . 0.0 110.679 173.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -41.75 97.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.36 0.527 . . . . 0.0 112.231 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -63.3 -44.98 93.45 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.398 0.999 . . . . 0.0 111.913 173.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -58.42 -53.04 62.81 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.308 0.643 . . . . 0.0 110.807 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.4 mmp_? -62.0 -32.96 73.48 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.299 1.039 . . . . 0.0 113.049 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.69 -50.98 69.0 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.186 1.357 . . . . 0.0 111.42 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -67.06 -36.06 81.2 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.803 -0.561 . . . . 0.0 111.455 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -63.48 -44.69 93.69 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 169.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.4 m -58.22 -41.17 83.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.361 -0.837 . . . . 0.0 111.075 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.91 -40.48 91.51 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.26 97.63 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.349 0.977 . . . . 0.0 111.954 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -62.63 -44.09 97.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.932 1.293 . . . . 0.0 111.405 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -59.27 -44.82 92.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.489 0.715 . . . . 0.0 112.417 170.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -61.34 -43.12 99.41 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.079 0.854 . . . . 0.0 111.037 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.04 99.57 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 120.784 -1.197 . . . . 0.0 113.082 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.82 -32.4 73.66 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 121.317 -0.864 . . . . 0.0 113.116 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 35.3 tp -71.13 -31.98 68.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.667 1.587 . . . . 0.0 111.783 172.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.3 -44.93 93.62 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.985 -1.072 . . . . 0.0 111.135 169.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -52.88 -46.13 67.79 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.097 1.359 . . . . 0.0 111.417 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.33 96.86 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.72 -45.61 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.241 1.016 . . . . 0.0 111.016 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -60.18 -34.48 73.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.76 0.824 . . . . 0.0 112.665 177.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -80.82 -36.07 32.09 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.98 -31.18 68.53 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.63 -11.25 60.36 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 74.5 mt -114.19 -31.6 6.27 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.363 1.865 . . . . 0.0 113.42 -173.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.8 p -72.88 -20.87 61.02 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.045 1.738 . . . . 0.0 115.563 -172.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.23 -20.32 30.51 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.637 1.113 . . . . 0.0 114.313 176.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -128.38 147.02 62.08 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 127.861 2.465 . . . . 0.0 106.925 169.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -42.26 154.04 0.12 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.86 3.04 . . . . 0.0 114.511 169.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.6 162.24 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 126.119 1.768 . . . . 0.0 108.657 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.49 178.37 33.86 Favored Glycine 0 N--CA 1.468 0.828 0 CA-C-N 120.752 1.615 . . . . 0.0 115.35 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.6 124.11 53.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.737 1.215 . . . . 0.0 110.178 177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -79.39 139.87 37.61 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 126.599 1.96 . . . . 0.0 109.433 169.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -138.39 134.53 34.26 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 125.406 1.482 . . . . 0.0 108.872 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.1 t -142.76 -175.67 4.58 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.946 1.298 . . . . 0.0 111.843 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -55.69 -26.96 47.64 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -169.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.84 -5.37 1.33 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.52 175.66 13.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.621 1.168 . . . . 0.0 112.317 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 32.4 p90 -151.8 157.95 42.63 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.451 1.901 . . . . 0.0 110.138 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.5 ttp180 -159.26 134.15 8.1 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.804 1.242 . . . . 0.0 112.39 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.2 mt -68.21 147.01 12.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 123.811 0.844 . . . . 0.0 110.114 176.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 84.4 mtp -135.99 154.46 51.07 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.942 1.697 . . . . 0.0 111.249 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 m -146.85 165.23 20.02 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 126.16 1.784 . . . . 0.0 111.256 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -62.93 159.14 39.53 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.168 1.912 . . . . 0.0 111.184 169.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -152.87 -62.16 0.01 OUTLIER Glycine 0 N--CA 1.475 1.235 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -65.63 -29.43 70.01 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.313 1.056 . . . . 0.0 113.625 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 t -154.1 137.64 10.54 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 125.102 1.361 . . . . 0.0 110.375 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -80.75 2.62 8.41 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.127 3.218 . . . . 0.0 113.193 170.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.0 m -122.43 -2.25 9.0 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -148.01 153.52 39.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.205 1.002 . . . . 0.0 111.914 173.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.8 t-105 -53.14 105.56 0.13 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.858 1.663 . . . . 0.0 114.331 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.479 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.8 tpm_? -156.05 159.01 38.75 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.999 1.72 . . . . 0.0 110.207 169.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.479 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 96.6 m95 -140.04 139.32 35.93 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.265 1.426 . . . . 0.0 112.093 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.51 154.87 73.79 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 126.907 2.083 . . . . 0.0 109.411 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.47 136.27 36.15 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.531 2.154 . . . . 0.0 112.616 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.72 -16.95 64.25 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.842 1.257 . . . . 0.0 112.869 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -48.36 -18.94 0.26 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.319 1.848 . . . . 0.0 113.438 168.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -50.75 -28.62 9.57 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.796 1.239 . . . . 0.0 113.883 169.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -139.71 0.26 1.8 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 117.119 2.266 . . . . 0.0 117.119 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.39 57.57 1.8 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.706 1.203 . . . . 0.0 109.515 169.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.68 -27.27 0.47 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 118.266 2.691 . . . . 0.0 118.266 -169.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -129.73 2.89 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 114.576 1.324 . . . . 0.0 114.576 -174.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -127.11 -13.06 5.73 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.533 1.133 . . . . 0.0 113.634 -178.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 52.1 p -73.66 -10.72 59.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.93 1.292 . . . . 0.0 114.411 172.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -121.18 177.25 5.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.031 1.732 . . . . 0.0 111.482 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -54.17 126.29 22.35 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.04 0.924 . . . . 0.0 112.954 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -157.49 29.94 0.28 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 128.993 2.917 . . . . 0.0 107.41 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -112.83 -9.32 13.67 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -167.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.39 170.21 16.42 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.391 1.076 . . . . 0.0 113.552 -175.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -138.92 2.46 2.15 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.71 1.204 . . . . 0.0 114.246 173.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -156.47 17.02 0.33 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.131 0.972 . . . . 0.0 113.444 -169.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.52 157.16 32.64 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.345 -1.472 . . . . 0.0 113.086 -169.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.8 t -135.82 142.85 44.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.854 2.062 . . . . 0.0 109.063 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.99 147.18 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.597 1.159 . . . . 0.0 111.14 -169.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -137.22 162.47 33.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.092 1.757 . . . . 0.0 110.264 173.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 73.6 mt -127.91 158.73 37.02 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.14 139.93 13.56 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 125.684 1.594 . . . . 0.0 109.227 169.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -76.4 -7.59 27.93 Favored 'Cis proline' 0 CA--C 1.545 1.043 0 CA-C-N 121.537 1.585 . . . . 0.0 113.399 -8.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -62.96 177.94 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.262 1.425 . . . . 0.0 112.167 169.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -135.78 146.68 58.1 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.6 1.16 . . . . 0.0 113.352 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -81.57 107.05 1.75 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.439 2.759 . . . . 0.0 110.115 169.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -157.77 160.01 37.39 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.087 0.955 . . . . 0.0 112.342 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.99 38.43 0.11 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 127.468 2.307 . . . . 0.0 114.02 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.8 m -59.4 156.62 12.56 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.008 1.723 . . . . 0.0 114.353 -175.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -69.6 -0.98 7.63 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.402 1.481 . . . . 0.0 114.629 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -143.58 165.19 26.28 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 127.448 2.299 . . . . 0.0 110.278 -176.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.72 155.82 64.95 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.172 1.915 . . . . 0.0 111.965 169.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -91.24 -14.95 30.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.663 1.185 . . . . 0.0 112.493 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.3 t -132.46 139.22 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 126.103 1.761 . . . . 0.0 109.078 177.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 83.1 t -133.09 147.53 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 119.443 1.02 . . . . 0.0 112.227 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -126.86 116.43 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 128.66 2.784 . . . . 0.0 108.942 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -70.83 160.32 32.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.209 1.804 . . . . 0.0 111.981 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.97 -7.05 10.03 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -121.67 10.67 10.38 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 0.0 112.992 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.95 7.86 63.91 Favored Glycine 0 CA--C 1.535 1.331 0 N-CA-C 115.963 1.145 . . . . 0.0 115.963 173.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -75.65 150.95 37.84 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.947 1.373 . . . . 0.0 107.801 169.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.5 mm -130.41 143.61 40.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 124.531 1.132 . . . . 0.0 108.939 -172.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 p -52.05 118.89 13.01 Favored Pre-proline 0 N--CA 1.473 0.699 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.1 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.78 115.06 2.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.016 2.477 . . . . 0.0 112.811 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.492 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.8 p90 -155.03 179.14 9.43 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.006 1.323 . . . . 0.0 112.908 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.9 p -143.24 152.91 42.25 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 125.331 1.452 . . . . 0.0 110.883 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.45 119.21 17.2 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 127.265 2.226 . . . . 0.0 108.806 -169.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.2 tt -110.94 145.86 37.62 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.349 1.46 . . . . 0.0 110.353 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 42.9 mtt -127.29 129.99 48.71 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.816 1.247 . . . . 0.0 110.355 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -129.99 141.71 50.72 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.528 1.531 . . . . 0.0 112.192 -171.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -61.05 109.92 1.22 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.321 1.849 . . . . 0.0 110.925 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -18.22 57.03 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -177.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.59 -16.47 68.38 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.314 0.959 . . . . 0.0 114.561 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.8 m -130.53 -27.53 2.15 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.706 1.253 . . . . 0.0 113.64 -169.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.83 36.86 40.77 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.1 0.857 . . . . 0.0 113.09 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -131.83 129.05 21.82 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.221 1.409 . . . . 0.0 111.071 -170.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.54 148.54 52.76 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.841 3.027 . . . . 0.0 114.914 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.12 -38.94 2.97 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.109 1.364 . . . . 0.0 110.973 169.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 39.9 tp -148.58 152.51 36.91 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 126.256 1.822 . . . . 0.0 110.151 -168.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.2 m -145.15 148.88 34.07 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 124.452 1.101 . . . . 0.0 108.931 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.6 mp -117.98 146.55 43.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 127.253 2.221 . . . . 0.0 108.405 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.23 141.67 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.122 0.969 . . . . 0.0 111.298 -174.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.492 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 21.9 t -120.38 121.25 38.15 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.94 1.696 . . . . 0.0 111.662 -176.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 61.7 p -74.94 -14.52 60.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.76 1.224 . . . . 0.0 114.004 170.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.33 2.77 4.02 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 125.786 1.66 . . . . 0.0 114.449 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.7 t -152.91 161.09 42.98 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.956 1.378 . . . . 0.0 113.136 -175.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -46.98 144.81 3.62 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 127.435 2.294 . . . . 0.0 113.774 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -107.87 17.25 6.93 Favored 'Cis proline' 0 CA--C 1.55 1.312 0 CA-C-N 120.744 1.301 . . . . 0.0 114.381 -2.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp 74.29 168.49 0.3 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 127.696 2.398 . . . . 0.0 112.405 -169.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -129.14 135.78 49.33 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.514 1.126 . . . . 0.0 111.558 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -82.68 155.77 24.18 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.725 1.21 . . . . 0.0 112.82 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 10.9 t -151.23 140.66 21.5 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.607 1.963 . . . . 0.0 109.976 169.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.61 130.63 43.63 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.389 -0.82 . . . . 0.0 109.383 169.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.07 63.2 0.27 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.376 1.871 . . . . 0.0 115.381 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 47.72 24.01 0.5 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 117.737 2.495 . . . . 0.0 117.737 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -57.67 -28.91 64.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -175.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.5 p -91.41 -8.15 48.7 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 175.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -63.95 -39.71 47.85 Favored Pre-proline 0 N--CA 1.478 0.975 0 CA-C-O 115.95 -1.976 . . . . 0.0 115.019 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo . . . . . 0 C--O 1.251 1.127 0 C-N-CA 124.09 3.194 . . . . 0.0 115.296 177.425 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.46 -14.68 5.26 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.734 2.413 . . . . 0.0 114.761 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.2 t -118.13 -41.61 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.334 1.454 . . . . 0.0 110.514 170.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.39 79.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.301 0.955 . . . . 0.0 113.531 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -57.06 -34.93 68.75 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.188 0.904 . . . . 0.0 113.284 176.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.8 m -81.84 -49.85 9.89 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.183 0.993 . . . . 0.0 111.053 174.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -67.28 -26.67 66.66 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.9 -43.94 94.46 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.719 1.145 . . . . 0.0 111.812 169.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -67.19 -37.88 84.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.887 0.875 . . . . 0.0 110.922 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -63.06 -46.15 88.82 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.6 m -58.74 -40.91 85.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.934 0.893 . . . . 0.0 111.242 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.34 92.98 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.573 1.149 . . . . 0.0 113.297 174.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.53 96.86 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.801 . . . . 0.0 112.056 173.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.7 mtt85 -62.75 -45.65 91.7 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.561 1.144 . . . . 0.0 111.553 175.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -57.95 -45.33 86.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.727 0.811 . . . . 0.0 112.559 170.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.6 m -62.01 -43.29 99.14 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.886 0.766 . . . . 0.0 111.02 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.16 96.65 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.869 -1.144 . . . . 0.0 112.968 172.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.56 -32.14 73.57 Favored 'General case' 0 CA--C 1.547 0.842 0 O-C-N 121.346 -0.846 . . . . 0.0 113.269 175.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 tp -72.51 -34.68 67.78 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.879 1.272 . . . . 0.0 111.74 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.42 -45.09 94.68 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.969 -1.082 . . . . 0.0 110.778 169.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.89 -46.54 64.57 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.325 1.45 . . . . 0.0 110.921 169.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.16 -39.54 94.97 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.62 -46.33 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.833 0.853 . . . . 0.0 110.784 174.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.08 -38.17 87.8 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.137 0.575 . . . . 0.0 112.525 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -68.18 -34.15 75.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.402 1.081 . . . . 0.0 112.281 175.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -24.67 64.15 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.9 t -83.46 -12.32 56.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.262 0.937 . . . . 0.0 112.884 173.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.88 -27.57 9.64 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.367 1.067 . . . . 0.0 113.559 -174.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.0 m -85.12 -20.74 29.84 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.59 0.59 89.28 Favored Glycine 0 CA--C 1.542 1.724 0 N-CA-C 115.233 0.853 . . . . 0.0 115.233 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -142.35 151.11 57.22 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 127.611 2.364 . . . . 0.0 107.168 169.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -47.05 157.46 0.58 Allowed 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.912 2.408 . . . . 0.0 113.0 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 78.2 t -120.02 158.99 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.173 1.389 . . . . 0.0 108.904 -173.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.39 174.51 30.55 Favored Glycine 0 CA--C 1.519 0.327 0 O-C-N 121.316 -0.865 . . . . 0.0 115.102 -177.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.5 122.2 47.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 C-N-CA 124.774 1.23 . . . . 0.0 107.817 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -90.55 146.12 24.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.345 1.458 . . . . 0.0 110.579 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -140.88 131.71 25.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.977 1.711 . . . . 0.0 110.572 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 82.5 p -148.82 169.56 20.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.792 1.237 . . . . 0.0 112.495 175.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.14 -29.53 68.71 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 171.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 51.8 m -76.46 -49.88 15.48 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.262 1.025 . . . . 0.0 112.626 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.19 173.22 9.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.903 1.681 . . . . 0.0 112.1 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 38.5 p90 -127.62 147.43 50.36 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.328 1.451 . . . . 0.0 109.101 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.8 ptt-85 -155.62 147.54 23.32 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.31 1.044 . . . . 0.0 113.088 -169.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.5 mm -78.71 140.56 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.055 0.942 . . . . 0.0 109.209 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.7 mtp -136.17 148.53 48.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.164 0.986 . . . . 0.0 112.932 -177.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.6 m -143.79 169.67 9.92 Favored Pre-proline 0 N--CA 1.477 0.91 0 C-N-CA 127.709 2.404 . . . . 0.0 111.158 -169.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -54.81 -41.84 74.36 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.99 2.46 . . . . 0.0 114.312 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.87 -65.47 0.02 OUTLIER Glycine 0 CA--C 1.537 1.454 0 C-N-CA 127.624 2.535 . . . . 0.0 115.767 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -68.48 -54.63 15.66 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.28 1.432 . . . . 0.0 112.31 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.4 t -161.23 143.32 9.04 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 124.459 1.104 . . . . 0.0 112.296 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -79.93 -16.78 11.16 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 123.458 2.772 . . . . 0.0 112.789 169.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.8 m -73.92 -13.0 60.83 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -169.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -150.27 153.07 35.53 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.281 1.433 . . . . 0.0 111.031 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -58.24 113.18 1.82 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.859 1.264 . . . . 0.0 111.798 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.477 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.5 tpm_? -154.07 161.36 41.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.346 1.458 . . . . 0.0 110.174 174.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.477 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 92.7 m95 -139.8 139.64 36.45 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.991 1.316 . . . . 0.0 112.199 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.9 t -143.84 141.9 19.49 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 107.149 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.415 ' C ' ' H ' ' A' ' 65' ' ' GLN . 56.6 Cg_endo -61.84 146.97 96.19 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 121.679 1.586 . . . . 0.0 111.065 170.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.4 tp -66.98 10.91 0.12 Allowed 'General case' 0 CA--C 1.555 1.155 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 63' ' ' PRO . 41.5 mt-30 -61.85 -18.94 61.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.408 1.483 . . . . 0.0 112.729 178.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -62.05 -20.93 64.48 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.131 1.372 . . . . 0.0 113.987 171.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -146.27 -20.88 0.44 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 -175.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -111.41 11.86 21.5 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.493 1.117 . . . . 0.0 112.724 172.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.29 -169.25 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.181 2.192 . . . . 0.0 114.467 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -59.8 -11.11 4.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -68.37 -8.97 44.84 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.52 1.528 . . . . 0.0 113.763 170.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.0 m -63.64 8.87 0.07 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.609 1.964 . . . . 0.0 115.938 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -156.05 162.24 40.32 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.953 1.301 . . . . 0.0 114.113 -169.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.5 ' ND2' ' H ' ' A' ' 75' ' ' ASP . 7.2 t30 48.48 -158.36 0.06 Allowed 'General case' 0 CA--C 1.561 1.392 0 C-N-CA 126.902 2.081 . . . . 0.0 115.689 169.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.5 ' H ' ' ND2' ' A' ' 74' ' ' ASN . 1.0 OUTLIER 56.75 -6.76 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 120.669 3.581 . . . . 0.0 120.669 168.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -60.39 -21.13 61.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.853 1.661 . . . . 0.0 114.21 173.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -129.32 159.33 36.49 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.336 1.855 . . . . 0.0 112.244 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -141.88 18.53 2.14 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.37 1.068 . . . . 0.0 113.545 169.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.05 4.49 0.47 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.783 1.233 . . . . 0.0 113.993 -172.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -125.71 170.83 11.15 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.279 1.832 . . . . 0.0 111.5 -171.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 21.4 t -136.82 141.52 42.88 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.432 1.893 . . . . 0.0 109.123 169.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.64 145.6 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.348 1.459 . . . . 0.0 111.198 -169.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -141.05 152.31 44.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.197 1.799 . . . . 0.0 110.567 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.6 mt -118.96 144.8 46.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.211 1.004 . . . . 0.0 111.439 171.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -172.81 114.44 0.37 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 127.217 2.207 . . . . 0.0 110.585 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.74 156.4 4.28 Favored 'Cis proline' 0 N--CA 1.452 -0.922 0 CA-C-N 121.363 1.523 . . . . 0.0 115.586 -10.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 79.31 -171.8 0.05 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 130.299 3.44 . . . . 0.0 110.947 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.65 148.41 43.03 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 124.183 0.993 . . . . 0.0 113.078 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.06 84.86 1.91 Allowed 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.787 2.991 . . . . 0.0 111.39 175.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -142.71 142.83 32.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.93 1.292 . . . . 0.0 111.148 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -71.74 66.06 0.52 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.537 1.535 . . . . 0.0 114.155 -173.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.5 t -67.15 156.64 35.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.603 1.961 . . . . 0.0 113.661 -178.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -69.25 -8.4 45.58 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.32 1.448 . . . . 0.0 113.451 171.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -136.49 163.61 48.61 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 126.204 1.801 . . . . 0.0 111.368 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -69.88 145.47 56.52 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 121.814 1.676 . . . . 0.0 110.477 168.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.01 -49.4 24.49 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.043 0.537 . . . . 0.0 110.957 171.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.4 t -89.8 135.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.962 1.305 . . . . 0.0 109.663 -177.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.2 t -132.89 145.6 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.906 0.882 . . . . 0.0 111.644 -176.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -127.81 136.33 60.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 128.445 2.698 . . . . 0.0 109.279 -169.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.6 mt -104.97 161.37 14.26 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.772 0.796 . . . . 0.0 112.074 170.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.44 -22.17 41.7 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -170.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -103.59 5.13 36.38 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.952 1.301 . . . . 0.0 113.781 -177.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.51 8.74 57.19 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 115.552 0.981 . . . . 0.0 115.552 172.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -84.45 139.43 32.2 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.211 1.505 . . . . 0.0 108.161 169.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.9 mm -130.9 154.65 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 125.461 1.504 . . . . 0.0 109.858 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.1 p -55.73 127.93 68.46 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.857 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.74 126.85 11.08 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 122.203 1.935 . . . . 0.0 111.047 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.501 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.5 p90 -160.38 -177.41 6.21 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.905 1.682 . . . . 0.0 112.069 -177.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.58 148.68 39.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.698 0.799 . . . . 0.0 111.165 170.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.0 tp -133.17 120.35 21.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 127.929 2.492 . . . . 0.0 108.257 -170.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.5 tt -115.32 146.14 41.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.525 1.13 . . . . 0.0 110.413 -174.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 48.4 mtt -128.3 140.43 51.88 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 125.404 1.481 . . . . 0.0 109.561 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.09 147.59 49.58 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.742 1.217 . . . . 0.0 111.481 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -61.41 122.39 15.06 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.312 1.045 . . . . 0.0 109.838 173.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.18 -21.31 64.99 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -171.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -96.64 -28.57 8.83 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-N 119.119 0.872 . . . . 0.0 114.219 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 79.6 p -93.01 -27.94 16.7 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.682 1.241 . . . . 0.0 112.969 176.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.96 7.93 72.01 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.695 1.14 . . . . 0.0 113.354 -169.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -89.36 135.23 31.42 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.972 1.309 . . . . 0.0 111.401 -174.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.55 142.43 17.98 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 123.78 2.987 . . . . 0.0 113.517 172.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -131.86 -47.12 0.94 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 110.993 -169.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -144.64 156.61 44.19 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.069 1.748 . . . . 0.0 108.79 177.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 91.4 m -146.55 146.93 30.66 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 110.031 173.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.7 mp -123.49 146.99 47.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 127.431 2.293 . . . . 0.0 109.08 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 11.7 t -141.01 136.33 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.255 0.622 . . . . 0.0 111.912 -171.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.501 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.2 t -116.74 116.74 28.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.636 1.574 . . . . 0.0 110.594 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.8 p -78.19 -12.67 60.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.929 1.292 . . . . 0.0 114.295 173.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 131.7 -0.05 4.94 Favored Glycine 0 CA--C 1.538 1.494 0 C-N-CA 125.312 1.434 . . . . 0.0 114.701 -177.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.3 p -153.81 157.66 39.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.794 1.297 . . . . 0.0 113.648 -176.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -58.81 136.61 87.02 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 126.332 1.853 . . . . 0.0 115.135 177.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -96.14 176.27 10.26 Favored 'Cis proline' 0 CA--C 1.548 1.212 0 CA-C-N 120.193 1.105 . . . . 0.0 110.584 -11.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.21 153.18 44.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.93 -1.107 . . . . 0.0 111.73 169.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -81.14 170.47 16.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.118 1.367 . . . . 0.0 110.474 169.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -138.22 147.28 43.59 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.05 1.74 . . . . 0.0 111.391 176.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.5 t -150.41 150.12 30.96 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.552 1.541 . . . . 0.0 110.946 173.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.37 137.2 44.56 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 30.05 59.28 0.19 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.203 2.201 . . . . 0.0 115.565 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.255 23.4 ptt85 47.1 28.26 0.91 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 127.594 2.358 . . . . 0.0 117.215 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.41 -31.94 68.18 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.8 p -89.6 -2.12 58.22 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 173.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.3 86.33 19.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 125.436 1.494 . . . . 0.0 111.245 -169.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo . . . . . 0 C--O 1.25 1.09 0 C-N-CA 123.602 2.868 . . . . 0.0 113.102 169.872 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -65.4 -32.48 74.13 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.235 1.38 . . . . 0.0 112.613 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.11 -46.8 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.147 169.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.95 -41.98 99.67 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.024 0.829 . . . . 0.0 112.387 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -62.08 -47.52 84.28 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.763 0.825 . . . . 0.0 112.589 173.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.6 m -61.28 -52.01 66.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 122.868 0.467 . . . . 0.0 110.833 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -63.05 -34.69 78.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.404 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.62 67.84 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.657 1.571 . . . . 0.0 111.389 174.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -66.29 -42.62 88.11 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -60.52 -44.5 95.99 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.401 0.68 . . . . 0.0 112.15 171.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.9 m -57.64 -44.19 85.44 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.285 0.948 . . . . 0.0 111.424 174.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.4 -43.65 98.31 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.86 -44.05 94.29 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.645 -0.659 . . . . 0.0 112.246 175.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -65.43 -44.19 88.13 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.71 -0.619 . . . . 0.0 111.495 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.0 -41.73 92.73 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.529 0.732 . . . . 0.0 111.984 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.5 m -60.49 -42.97 97.4 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.069 0.85 . . . . 0.0 111.473 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.72 -40.71 92.47 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.833 -1.167 . . . . 0.0 113.225 173.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.97 -31.59 72.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.039 0.936 . . . . 0.0 113.005 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.0 tp -70.44 -36.85 74.19 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.789 1.236 . . . . 0.0 111.399 172.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -62.8 -44.88 94.99 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 121.056 -1.027 . . . . 0.0 111.8 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -54.07 -46.18 71.93 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.722 1.209 . . . . 0.0 111.796 170.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.49 -41.77 86.08 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 174.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.4 mt -62.41 -47.12 94.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 119.274 0.943 . . . . 0.0 110.512 173.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.05 -24.54 67.15 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.363 1.065 . . . . 0.0 113.775 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.06 -30.71 12.89 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -27.58 66.85 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 120.218 1.372 . . . . 0.0 113.691 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -74.13 -25.43 59.76 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.25 -27.45 13.19 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.38 1.072 . . . . 0.0 113.63 -173.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.7 m -86.84 -7.67 58.01 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.58 -3.06 80.5 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 124.592 1.091 . . . . 0.0 115.522 172.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -146.37 151.96 45.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 127.83 2.452 . . . . 0.0 107.294 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -42.12 153.01 0.14 Allowed 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 124.375 3.383 . . . . 0.0 115.303 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 74.3 t -110.78 162.51 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 126.331 1.852 . . . . 0.0 108.822 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.28 176.24 35.29 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 116.611 1.404 . . . . 0.0 116.611 -175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 4.4 mp -135.24 131.01 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 125.378 1.471 . . . . 0.0 109.331 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -95.32 148.47 22.39 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.123 1.369 . . . . 0.0 110.928 173.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -138.79 143.36 38.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.079 1.752 . . . . 0.0 111.022 -173.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 77.8 p -142.05 176.37 9.01 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.734 1.614 . . . . 0.0 111.569 -173.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.94 -32.15 52.77 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.09 1.57 2.04 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -171.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.68 174.8 14.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.935 1.294 . . . . 0.0 112.598 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -143.02 159.99 41.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 127.044 2.138 . . . . 0.0 108.569 173.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -152.49 150.72 29.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.88 144.04 12.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.772 0.829 . . . . 0.0 110.431 176.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -135.39 147.89 49.19 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.754 1.622 . . . . 0.0 110.958 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.6 m -140.75 161.91 51.68 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 125.063 1.345 . . . . 0.0 110.875 -170.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -49.76 144.74 19.56 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.238 2.625 . . . . 0.0 114.751 177.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.39 -156.42 7.87 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.017 1.294 . . . . 0.0 114.145 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -53.46 -22.1 7.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -173.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.8 t -146.96 143.61 18.64 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.922 1.289 . . . . 0.0 112.158 -177.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.68 -10.98 12.94 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 123.66 2.907 . . . . 0.0 112.372 169.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.1 t -65.03 -25.31 67.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.948 1.299 . . . . 0.0 113.907 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.52 157.92 43.77 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.45 1.5 . . . . 0.0 111.209 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 44.3 t-105 -53.23 115.44 1.9 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.646 1.578 . . . . 0.0 112.079 177.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.4 tpp85 -155.89 152.22 28.03 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.241 1.416 . . . . 0.0 110.885 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -144.1 150.82 38.73 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 26.8 m -144.17 153.89 56.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 126.237 1.815 . . . . 0.0 110.191 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.31 147.84 72.85 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.137 1.891 . . . . 0.0 110.261 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.8 tp -78.16 52.98 1.15 Allowed 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.849 0.833 . . . . 0.0 111.037 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -128.83 18.71 6.15 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.442 1.497 . . . . 0.0 113.359 -169.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -63.14 -25.07 68.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.86 0.864 . . . . 0.0 113.052 172.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -149.46 -36.71 0.16 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.711 1.204 . . . . 0.0 113.406 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.74 29.46 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.645 1.578 . . . . 0.0 113.65 171.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.4 -37.63 49.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.177 1.791 . . . . 0.0 115.018 -169.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -103.59 12.09 35.37 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.466 1.507 . . . . 0.0 112.89 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -130.27 -33.74 1.68 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.752 1.221 . . . . 0.0 113.076 -172.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 75.2 m -75.63 9.15 2.41 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.186 1.394 . . . . 0.0 114.35 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -143.61 157.08 44.69 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.699 1.2 . . . . 0.0 112.67 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 40.64 -1.32 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 170.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.12 -27.83 69.35 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 121.652 2.024 . . . . 0.0 114.588 -173.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -70.06 -17.07 63.23 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.141 1.376 . . . . 0.0 113.91 -174.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -136.68 152.39 50.34 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.607 1.563 . . . . 0.0 114.161 -169.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -141.97 -6.77 0.96 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -141.98 18.34 2.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.06 1.344 . . . . 0.0 111.972 -169.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -125.9 154.88 42.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.57 1.148 . . . . 0.0 112.824 -169.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.1 m -127.47 145.37 50.86 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 127.52 2.328 . . . . 0.0 108.518 169.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -118.04 148.67 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.592 1.157 . . . . 0.0 111.108 -169.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -138.06 151.28 47.69 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.27 1.828 . . . . 0.0 109.664 172.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.2 tt -148.02 146.03 28.74 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.893 0.877 . . . . 0.0 111.439 -174.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.69 153.63 43.28 Favored Pre-proline 0 N--CA 1.472 0.646 0 C-N-CA 125.775 1.63 . . . . 0.0 111.227 176.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -81.48 -13.31 37.45 Favored 'Cis proline' 0 CA--C 1.543 0.926 0 CA-C-N 120.542 1.229 . . . . 0.0 114.426 0.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -63.46 142.75 58.28 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.78 1.232 . . . . 0.0 112.945 -176.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -59.56 112.99 6.03 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.024 1.73 . . . . 0.0 111.67 172.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -86.03 -178.78 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.228 2.618 . . . . 0.0 112.407 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.1 t70 70.96 -44.95 0.6 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 119.104 3.001 . . . . 0.0 119.104 168.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -138.77 12.7 2.7 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -170.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.6 t -56.93 150.54 16.45 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -74.08 -11.52 60.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.898 1.279 . . . . 0.0 113.252 171.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.13 162.37 58.04 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 125.354 1.462 . . . . 0.0 111.507 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -65.14 140.28 64.45 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.503 1.468 . . . . 0.0 110.306 169.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -71.01 -22.0 62.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.668 0.787 . . . . 0.0 112.509 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 62.1 t -116.33 128.19 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.883 0.873 . . . . 0.0 109.753 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.3 t -131.18 140.84 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.478 1.111 . . . . 0.0 110.554 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -126.53 124.24 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 126.575 1.95 . . . . 0.0 110.983 -169.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.7 mt -82.69 159.59 22.58 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.172 0.987 . . . . 0.0 112.041 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.35 -25.81 62.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.966 1.306 . . . . 0.0 114.345 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -87.64 -0.37 56.78 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 113.513 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.94 10.92 80.08 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.344 -0.847 . . . . 0.0 114.323 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -79.38 142.25 36.16 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.574 -0.957 . . . . 0.0 109.232 169.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -132.65 145.85 33.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 125.239 1.416 . . . . 0.0 109.094 -169.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.5 p -52.16 135.08 40.29 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 123.842 0.857 . . . . 0.0 112.286 169.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -70.78 123.48 9.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.763 2.309 . . . . 0.0 110.658 169.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.46 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 29.0 p90 -158.6 175.61 13.43 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.094 1.358 . . . . 0.0 112.14 175.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -137.68 144.72 41.94 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.227 1.411 . . . . 0.0 108.502 169.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.8 tp -136.85 116.15 12.63 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.658 1.983 . . . . 0.0 109.215 -169.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -110.42 146.35 36.02 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.953 1.301 . . . . 0.0 110.607 -175.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.4 mtt -126.11 138.24 53.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.773 1.629 . . . . 0.0 109.293 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -139.42 149.5 44.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.126 1.37 . . . . 0.0 111.69 -174.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -63.92 118.69 8.77 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.572 0.749 . . . . 0.0 110.699 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.29 -23.45 62.43 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -85.57 -17.69 61.6 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 123.873 0.749 . . . . 0.0 114.241 175.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.1 m -118.81 -24.55 6.6 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 118.21 1.005 . . . . 0.0 113.266 -169.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 64.29 33.82 88.27 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 123.604 0.621 . . . . 0.0 112.789 -171.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -125.93 127.04 24.84 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.59 1.556 . . . . 0.0 110.379 -170.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -51.74 148.01 23.02 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.204 3.269 . . . . 0.0 115.553 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.64 -51.76 1.93 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 127.101 2.16 . . . . 0.0 111.51 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -150.64 155.37 39.23 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.776 1.631 . . . . 0.0 108.637 -169.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.0 m -145.66 138.39 25.87 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 110.052 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.1 mp -111.2 149.22 31.27 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.363 2.265 . . . . 0.0 109.795 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 28.3 t -144.42 138.25 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.696 1.198 . . . . 0.0 111.871 -169.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.46 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 14.1 t -117.28 158.18 24.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.433 1.493 . . . . 0.0 112.125 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 83.0 p -133.06 -2.02 3.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.727 1.611 . . . . 0.0 114.311 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 125.3 -14.33 7.36 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.912 1.244 . . . . 0.0 115.101 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 55.7 m -142.35 152.55 43.01 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.826 1.251 . . . . 0.0 112.436 -172.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 47.5 t-105 -53.7 134.68 55.32 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.471 1.509 . . . . 0.0 114.678 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -99.9 178.2 6.05 Favored 'Cis proline' 0 CA--C 1.55 1.276 0 CA-C-N 120.53 1.225 . . . . 0.0 111.272 -11.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.7 mp -67.76 168.6 11.11 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.191 -0.943 . . . . 0.0 112.079 169.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -114.08 164.6 13.61 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.389 1.475 . . . . 0.0 109.654 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -142.88 156.33 44.9 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.2 t -151.5 154.64 36.94 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.37 1.868 . . . . 0.0 111.084 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.01 133.82 47.64 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.494 -0.754 . . . . 0.0 109.047 169.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.82 63.1 0.13 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.646 1.978 . . . . 0.0 115.637 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 55.7 ptt85 46.46 25.77 0.43 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 127.83 2.452 . . . . 0.0 117.252 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.63 -33.62 71.74 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 -174.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.9 p -77.48 -20.95 53.59 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 20.1 mtp-105 -74.07 152.51 88.52 Favored Pre-proline 0 N--CA 1.475 0.795 0 C-N-CA 124.073 0.949 . . . . 0.0 112.768 -170.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 C--O 1.249 1.048 0 C-N-CA 123.788 2.992 . . . . 0.0 113.172 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.16 -36.43 79.79 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.126 1.33 . . . . 0.0 112.782 170.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.8 t -70.16 -41.84 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.62 0.768 . . . . 0.0 110.127 173.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.8 -39.88 95.65 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.666 -0.646 . . . . 0.0 112.586 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -62.01 -46.34 89.62 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.682 0.793 . . . . 0.0 111.804 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.0 m -55.75 -53.81 52.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.143 0.577 . . . . 0.0 110.73 174.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.1 mmt-85 -62.12 -36.11 80.77 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 117.488 -1.244 . . . . 0.0 112.661 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.1 66.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 121.103 1.774 . . . . 0.0 111.722 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -63.87 -42.39 97.54 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.063 1.345 . . . . 0.0 111.666 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -64.79 -44.72 89.02 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.775 1.63 . . . . 0.0 112.99 174.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -62.92 -38.68 91.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.388 1.075 . . . . 0.0 111.273 175.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.09 84.24 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.57 -43.75 98.28 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.705 -0.622 . . . . 0.0 111.954 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -61.05 -48.95 79.38 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.787 1.235 . . . . 0.0 111.446 177.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -61.02 -42.29 98.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.779 -0.629 . . . . 0.0 112.399 174.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.9 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.439 1.018 . . . . 0.0 111.013 176.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.31 -42.22 99.0 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.973 -1.079 . . . . 0.0 113.396 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.1 -33.78 76.55 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.228 -0.92 . . . . 0.0 112.882 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.7 tp -71.3 -31.89 67.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.875 1.27 . . . . 0.0 111.797 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -62.97 -44.57 95.68 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.07 -1.019 . . . . 0.0 110.69 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 tp -54.02 -46.57 71.85 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.805 1.242 . . . . 0.0 111.468 169.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.0 -45.31 90.96 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.1 mt -61.98 -46.22 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 110.863 175.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -62.74 -33.37 75.0 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.933 0.893 . . . . 0.0 113.025 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -82.06 -27.03 33.18 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.247 1.019 . . . . 0.0 113.562 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.08 -38.32 85.83 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.927 1.24 . . . . 0.0 114.26 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.6 t -68.82 -32.5 72.25 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.407 -0.808 . . . . 0.0 112.144 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.86 -32.96 59.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.383 1.473 . . . . 0.0 112.804 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 75.0 m -72.23 -24.58 61.4 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.516 1.526 . . . . 0.0 114.446 -174.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.27 13.2 64.54 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 123.749 0.69 . . . . 0.0 114.153 -174.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -152.96 150.61 24.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.893 2.877 . . . . 0.0 107.178 -178.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -50.24 161.36 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.616 2.211 . . . . 0.0 112.824 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.0 t -122.55 159.65 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 125.15 1.38 . . . . 0.0 108.214 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.86 -174.8 28.02 Favored Glycine 0 N--CA 1.464 0.563 0 O-C-N 120.603 -1.31 . . . . 0.0 115.155 -176.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -125.64 127.96 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.491 1.116 . . . . 0.0 108.963 174.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -97.71 98.12 9.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.575 1.55 . . . . 0.0 108.275 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -84.85 126.55 33.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.54 1.136 . . . . 0.0 109.162 171.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 87.9 p -126.34 9.17 7.23 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -175.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 64.66 -37.46 0.21 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 128.338 2.655 . . . . 0.0 114.84 -172.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -62.66 -40.89 98.48 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.197 1.399 . . . . 0.0 111.516 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.8 -174.66 4.03 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 128.061 2.545 . . . . 0.0 109.29 169.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -147.63 135.1 20.78 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.108 -0.995 . . . . 0.0 110.492 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.37 151.28 39.07 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.769 1.228 . . . . 0.0 112.383 -173.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.1 mt -71.54 149.19 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.546 0.738 . . . . 0.0 109.142 171.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 6.0 ttt -138.55 139.53 38.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.228 1.411 . . . . 0.0 110.3 -172.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.54 164.55 30.0 Favored Pre-proline 0 N--CA 1.479 1.023 0 C-N-CA 126.492 1.917 . . . . 0.0 111.286 -169.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -68.01 164.46 31.82 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 121.787 1.658 . . . . 0.0 111.791 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.63 -59.69 0.01 OUTLIER Glycine 0 N--CA 1.472 1.066 0 CA-C-O 119.568 -0.573 . . . . 0.0 114.183 177.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -65.81 -30.78 71.46 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.272 1.036 . . . . 0.0 113.763 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.5 t -157.11 138.71 9.89 Favored Pre-proline 0 N--CA 1.471 0.616 0 C-N-CA 124.608 1.163 . . . . 0.0 110.95 169.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -87.05 4.69 6.08 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.266 3.311 . . . . 0.0 113.399 171.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.2 p -45.72 -58.54 3.38 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -162.95 -36.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.126 1.371 . . . . 0.0 113.462 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -152.84 106.22 3.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.818 0.847 . . . . 0.0 112.118 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.1 tpp85 -155.9 151.58 27.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.338 1.855 . . . . 0.0 109.607 169.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -144.54 135.83 25.36 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.7 m -143.01 151.64 56.5 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 128.255 2.622 . . . . 0.0 108.953 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.06 135.28 40.02 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 122.222 1.948 . . . . 0.0 111.095 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 tt -71.63 88.55 0.96 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.539 1.136 . . . . 0.0 109.317 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -135.74 -10.51 2.09 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -58.54 -27.68 64.76 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.651 1.114 . . . . 0.0 113.845 -177.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -135.94 24.56 3.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.454 1.902 . . . . 0.0 112.776 174.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.56 35.37 2.46 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.856 2.062 . . . . 0.0 109.718 172.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.72 118.58 4.34 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.049 1.74 . . . . 0.0 112.648 -169.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.1 t70 54.32 21.77 3.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.886 1.674 . . . . 0.0 115.101 -177.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -133.69 -12.18 2.66 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.9 t -63.87 -24.46 67.75 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.242 1.017 . . . . 0.0 113.551 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -151.6 165.61 33.77 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.762 1.225 . . . . 0.0 113.269 -177.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.74 -37.13 0.06 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 129.398 3.079 . . . . 0.0 116.66 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.91 -6.58 22.61 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.016 2.126 . . . . 0.0 113.935 173.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -42.97 -48.45 5.93 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.395 1.878 . . . . 0.0 114.574 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -158.16 -178.41 7.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.142 1.377 . . . . 0.0 112.549 -169.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -139.12 18.17 2.61 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.116 1.366 . . . . 0.0 112.922 171.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -146.93 -2.99 0.6 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.0 mt -118.08 160.08 22.12 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 -169.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.5 t -132.74 133.72 43.84 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.93 2.492 . . . . 0.0 107.802 169.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -109.66 145.62 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.542 1.137 . . . . 0.0 111.038 -169.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -136.99 155.2 50.01 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.965 1.706 . . . . 0.0 110.713 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.2 tt -145.62 147.36 31.95 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.604 1.161 . . . . 0.0 112.523 -169.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -154.03 153.44 28.49 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.282 1.833 . . . . 0.0 109.607 168.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -76.5 -13.62 27.25 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 120.84 1.336 . . . . 0.0 113.938 -2.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -67.85 173.15 4.64 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.339 1.056 . . . . 0.0 111.953 171.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.13 135.06 26.84 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.725 1.21 . . . . 0.0 112.449 -173.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.89 100.05 1.34 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.474 2.783 . . . . 0.0 109.87 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -159.93 141.85 13.02 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.321 1.449 . . . . 0.0 110.571 -171.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -59.83 87.05 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.736 1.214 . . . . 0.0 112.131 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.4 m -101.93 -6.57 23.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.361 1.864 . . . . 0.0 113.085 -169.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.0 20.97 4.63 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.729 2.011 . . . . 0.0 114.277 -177.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -157.29 163.47 24.83 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 127.244 2.218 . . . . 0.0 108.624 175.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.58 155.63 66.01 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 CA-C-N 120.26 1.129 . . . . 0.0 110.883 169.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -107.2 -44.88 4.25 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.088 0.555 . . . . 0.0 110.826 170.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.0 t -79.47 132.47 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.8 t -134.08 145.29 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.997 0.919 . . . . 0.0 111.865 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.72 131.53 72.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 C-N-CA 129.644 3.178 . . . . 0.0 107.984 -172.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.8 mt -96.43 157.72 15.77 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.279 0.562 . . . . 0.0 111.151 169.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.64 -22.73 47.29 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.28 -18.62 61.78 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.802 1.641 . . . . 0.0 113.507 174.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.36 5.18 63.75 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 124.933 1.254 . . . . 0.0 114.611 -176.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.29 144.25 29.84 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 118.323 1.062 . . . . 0.0 108.99 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 3.8 mm -131.47 150.27 34.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 125.334 1.454 . . . . 0.0 110.088 -168.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.6 p -57.59 121.91 52.13 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.685 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.36 127.98 28.22 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 122.736 2.29 . . . . 0.0 113.373 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -161.48 175.17 12.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.069 1.348 . . . . 0.0 112.558 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 79.1 p -136.42 150.02 48.56 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 123.749 0.82 . . . . 0.0 111.044 168.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.0 tp -130.38 106.35 8.49 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.795 2.038 . . . . 0.0 108.041 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -98.48 145.46 26.75 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.924 1.29 . . . . 0.0 110.022 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.2 mtt -128.67 128.96 45.13 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.905 1.682 . . . . 0.0 108.895 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.7 144.28 50.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 124.99 1.316 . . . . 0.0 110.764 -178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -69.61 104.54 2.4 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.089 1.356 . . . . 0.0 110.004 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.62 -20.98 66.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.625 1.17 . . . . 0.0 114.132 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -99.14 -7.19 55.2 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.775 1.179 . . . . 0.0 114.818 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.2 m -124.17 -29.11 3.62 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.579 1.152 . . . . 0.0 112.327 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 103.24 22.66 9.01 Favored Glycine 0 CA--C 1.534 1.275 0 N-CA-C 116.659 1.424 . . . . 0.0 116.659 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -140.18 143.46 33.8 Favored Pre-proline 0 N--CA 1.477 0.887 0 CA-C-N 119.491 1.645 . . . . 0.0 112.972 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.67 147.86 29.74 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.784 2.989 . . . . 0.0 113.503 169.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.87 -47.49 1.14 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.156 1.382 . . . . 0.0 112.513 -169.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -151.65 154.21 35.94 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.973 1.309 . . . . 0.0 108.954 -174.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 57.9 m -146.07 141.39 27.55 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 120.896 -1.127 . . . . 0.0 110.26 176.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.9 mp -113.35 148.95 34.73 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 126.589 1.955 . . . . 0.0 108.911 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.2 t -141.57 137.2 32.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.444 0.698 . . . . 0.0 111.875 -173.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.76 113.98 21.45 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.152 1.381 . . . . 0.0 110.94 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.7 m -75.52 -12.85 60.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 139.91 -3.09 2.5 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.851 1.215 . . . . 0.0 115.547 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 9.5 t -151.81 153.43 34.23 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.306 1.553 . . . . 0.0 112.87 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.5 t-105 -59.97 141.48 89.78 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 126.145 1.778 . . . . 0.0 115.244 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -91.44 176.05 17.44 Favored 'Cis proline' 0 CA--C 1.544 0.992 0 CA-C-N 119.793 0.962 . . . . 0.0 110.88 -11.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -67.96 152.69 45.14 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 122.226 1.012 . . . . 0.0 111.906 170.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.96 169.38 16.85 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.169 1.387 . . . . 0.0 109.523 169.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -137.51 147.21 45.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.339 1.456 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.2 t -152.13 154.57 36.14 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.247 1.419 . . . . 0.0 110.992 174.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.97 133.84 41.62 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 31.77 61.37 0.29 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.752 2.021 . . . . 0.0 115.551 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.305 0.0 OUTLIER 49.64 11.3 0.05 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 128.528 2.731 . . . . 0.0 118.209 -176.86 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.18 -34.07 63.54 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 3.2 m -91.68 -10.15 41.26 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.484 1.113 . . . . 0.0 113.288 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -64.97 -41.54 55.5 Favored Pre-proline 0 N--CA 1.478 0.961 0 CA-C-O 116.508 -1.711 . . . . 0.0 115.029 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo . . . . . 0 C--O 1.25 1.114 0 C-N-CA 124.317 3.345 . . . . 0.0 115.349 176.558 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -153.74 -30.69 0.12 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.54 1.536 . . . . 0.0 112.594 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.75 -29.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -43.09 -53.24 5.02 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 117.299 2.333 . . . . 0.0 117.299 -167.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -65.51 -21.11 66.59 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.7 m -93.43 -51.95 4.74 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.221 1.409 . . . . 0.0 110.487 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 tpt85 -59.23 -33.81 71.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.012 2.125 . . . . 0.0 113.091 -177.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.05 95.11 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.434 1.47 . . . . 0.0 112.597 173.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -67.04 -41.67 86.15 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.464 1.106 . . . . 0.0 110.871 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.07 -41.46 99.44 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.635 0.774 . . . . 0.0 112.168 172.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.6 m -61.13 -41.6 97.02 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.406 1.082 . . . . 0.0 111.184 175.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.09 -41.14 91.07 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.54 91.52 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.517 -0.739 . . . . 0.0 111.884 173.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -58.47 -46.99 85.5 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.299 1.439 . . . . 0.0 111.038 174.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -63.58 -42.88 98.26 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.44 1.096 . . . . 0.0 112.688 177.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.7 m -61.7 -44.73 96.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 118.727 0.694 . . . . 0.0 110.864 176.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.25 -41.79 98.76 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.144 -0.972 . . . . 0.0 113.082 173.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.09 -31.33 70.87 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.263 -0.898 . . . . 0.0 113.374 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.6 tp -71.15 -32.79 69.37 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.482 1.113 . . . . 0.0 111.414 171.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.54 -44.01 95.45 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.913 -1.117 . . . . 0.0 110.644 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -44.75 68.34 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.048 1.339 . . . . 0.0 111.236 169.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.79 -40.63 97.93 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 176.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -64.09 -44.99 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.744 0.817 . . . . 0.0 110.718 173.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -60.6 -39.37 87.89 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.347 0.659 . . . . 0.0 112.56 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -32.82 63.18 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.378 -0.826 . . . . 0.0 112.126 174.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -36.29 83.38 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 120.121 1.328 . . . . 0.0 112.48 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -21.92 60.46 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.902 -0.499 . . . . 0.0 112.268 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.38 -28.79 14.3 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.638 1.175 . . . . 0.0 113.216 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.5 m -77.55 -28.87 52.0 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -172.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.42 9.32 84.46 Favored Glycine 0 CA--C 1.542 1.771 0 CA-C-N 119.12 0.873 . . . . 0.0 114.629 -172.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -140.76 144.34 35.51 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 127.89 2.476 . . . . 0.0 106.637 169.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.71 158.61 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.651 2.901 . . . . 0.0 114.785 169.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.0 t -115.57 164.92 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.867 2.067 . . . . 0.0 108.204 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -155.99 174.53 33.91 Favored Glycine 0 N--CA 1.465 0.611 0 CA-C-N 120.402 1.456 . . . . 0.0 115.788 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 138.04 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.55 1.14 . . . . 0.0 108.773 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -114.89 125.59 53.82 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.109 2.163 . . . . 0.0 109.299 -169.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -127.26 127.1 43.85 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 110.895 -171.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.5 t -147.19 167.08 25.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.028 1.331 . . . . 0.0 112.053 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.33 -28.02 67.63 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.409 1.083 . . . . 0.0 112.697 173.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 p -71.88 -54.19 10.84 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.034 1.334 . . . . 0.0 112.58 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.66 173.4 13.94 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.356 2.262 . . . . 0.0 110.336 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -136.25 153.36 51.22 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.939 0.896 . . . . 0.0 111.508 169.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.8 ptp85 -158.28 163.21 37.61 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.822 1.249 . . . . 0.0 113.955 -170.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.9 mt -92.91 144.89 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.929 0.891 . . . . 0.0 109.724 170.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 92.0 mtp -134.45 149.79 50.78 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.964 1.706 . . . . 0.0 110.645 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.0 p -141.62 156.07 66.54 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.979 1.711 . . . . 0.0 111.299 -168.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -58.31 -29.99 89.65 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.085 2.523 . . . . 0.0 114.066 169.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 67.4 -68.47 0.25 Allowed Glycine 0 CA--C 1.529 0.942 0 C-N-CA 127.466 2.46 . . . . 0.0 115.496 169.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -135.6 -20.75 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.345 1.858 . . . . 0.0 114.436 -169.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.48 48.01 3.04 Favored Pre-proline 0 N--CA 1.485 1.281 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -169.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -65.82 4.69 0.79 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 123.973 3.115 . . . . 0.0 114.741 178.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.0 m -44.88 -33.79 2.1 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 129.184 2.994 . . . . 0.0 115.573 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -154.04 -51.65 0.1 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.552 1.141 . . . . 0.0 111.749 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.8 t-105 -158.91 125.3 4.58 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.478 1.511 . . . . 0.0 110.468 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -152.65 154.13 34.71 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.234 1.413 . . . . 0.0 111.14 174.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -141.87 151.0 42.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.823 1.249 . . . . 0.0 112.534 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.3 p -159.45 149.54 15.16 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 127.992 2.517 . . . . 0.0 108.12 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.28 140.22 42.77 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.577 2.185 . . . . 0.0 112.813 169.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.74 64.27 2.98 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.272 1.029 . . . . 0.0 110.371 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.415 HE22 ' NE2' ' A' ' 73' ' ' GLN . 35.6 mt-30 -131.05 5.65 4.53 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.658 1.583 . . . . 0.0 113.086 -170.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -62.03 -18.21 59.84 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.655 1.182 . . . . 0.0 113.961 176.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -133.85 -33.09 1.07 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.162 1.385 . . . . 0.0 113.026 173.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.82 -11.94 61.05 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 174.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.32 -55.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 129.934 3.294 . . . . 0.0 116.574 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.5 -15.15 0.24 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.778 1.631 . . . . 0.0 113.894 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -62.42 -21.29 65.29 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 120.801 -1.187 . . . . 0.0 114.085 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.0 m -76.65 -2.3 32.02 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.455 1.502 . . . . 0.0 114.735 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.415 ' NE2' HE22 ' A' ' 65' ' ' GLN . 22.1 pt20 -141.22 165.42 27.58 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.107 1.322 . . . . 0.0 112.863 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 41.2 t30 47.73 -52.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 130.362 3.465 . . . . 0.0 119.684 169.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -55.46 -13.68 1.61 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 127.412 2.285 . . . . 0.0 113.442 169.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 28.6 m95 -43.07 -30.26 0.42 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 115.604 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -149.17 154.88 39.81 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.928 1.24 . . . . 0.0 112.972 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -145.62 -19.64 0.47 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -177.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -136.99 16.35 3.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.548 1.539 . . . . 0.0 111.311 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -129.61 156.45 44.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.944 1.698 . . . . 0.0 110.532 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.2 m -125.44 130.65 52.26 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.288 1.835 . . . . 0.0 109.013 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.97 139.3 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.594 1.158 . . . . 0.0 110.06 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 -137.48 122.18 18.64 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.505 1.522 . . . . 0.0 109.357 -176.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.15 145.11 42.1 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.972 1.309 . . . . 0.0 111.994 -169.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -156.62 153.48 24.78 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.364 1.865 . . . . 0.0 110.19 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -75.02 -15.22 22.56 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 CA-C-N 120.347 1.16 . . . . 0.0 113.69 -3.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -61.06 125.57 24.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.202 1.001 . . . . 0.0 111.801 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 134.72 89.61 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 124.183 0.993 . . . . 0.0 112.52 177.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.98 108.64 2.36 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.049 2.5 . . . . 0.0 109.627 172.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -159.51 145.93 16.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.473 1.109 . . . . 0.0 111.851 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.85 48.22 0.46 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.446 1.498 . . . . 0.0 112.618 174.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.8 m -58.31 156.18 10.44 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.903 1.681 . . . . 0.0 113.207 -176.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -67.8 5.09 0.93 Allowed 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -159.45 164.35 20.82 Favored Pre-proline 0 CA--C 1.542 0.649 0 C-N-CA 127.346 2.258 . . . . 0.0 109.889 -176.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.89 149.68 83.13 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 121.407 1.405 . . . . 0.0 110.01 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -94.1 -42.81 8.8 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.039 -0.413 . . . . 0.0 111.987 176.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -73.79 138.53 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.227 1.011 . . . . 0.0 109.194 169.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 85.5 t -136.13 144.94 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.717 0.807 . . . . 0.0 111.772 -176.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.45 118.0 48.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 128.885 2.874 . . . . 0.0 108.072 -173.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.7 mt -82.53 163.41 21.54 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 122.275 1.036 . . . . 0.0 111.952 177.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.88 -13.69 11.99 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -176.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -120.12 9.44 11.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.561 . . . . 0.0 113.308 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.31 9.25 58.12 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 115.788 1.075 . . . . 0.0 115.788 174.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -75.49 136.56 40.63 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.942 1.371 . . . . 0.0 108.178 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.2 mm -130.14 144.69 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.706 1.203 . . . . 0.0 109.551 -172.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.6 p -54.75 133.56 65.44 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 121.656 -0.653 . . . . 0.0 110.931 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.49 98.49 1.18 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.506 2.137 . . . . 0.0 111.466 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 22.4 p90 -124.48 177.28 6.0 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.045 1.738 . . . . 0.0 111.945 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.2 t -140.26 145.57 37.49 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.802 1.241 . . . . 0.0 110.299 172.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 7.7 tp -130.45 92.14 3.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.128 2.171 . . . . 0.0 109.602 -169.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.1 tt -80.75 143.73 32.69 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.962 0.905 . . . . 0.0 109.921 176.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 63.2 mtt -127.31 133.11 50.15 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 126.028 1.731 . . . . 0.0 108.309 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.46 143.49 51.17 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.907 1.283 . . . . 0.0 110.693 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -66.92 109.46 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.764 0.826 . . . . 0.0 110.901 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.37 64.57 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.88 -0.04 75.57 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 125.653 1.597 . . . . 0.0 114.429 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -129.85 -37.45 1.53 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.704 1.201 . . . . 0.0 113.143 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 88.49 30.18 16.82 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 118.515 0.598 . . . . 0.0 114.014 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -141.65 139.67 18.95 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.123 1.369 . . . . 0.0 111.225 -169.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -49.61 144.63 18.93 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.912 3.075 . . . . 0.0 114.182 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -130.68 -50.08 1.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 110.603 -169.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.47 162.84 33.48 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.74 1.616 . . . . 0.0 110.174 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 9.4 m -147.99 117.51 7.01 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 123.882 0.873 . . . . 0.0 109.188 176.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.5 mp -92.4 149.51 21.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.8 1.24 . . . . 0.0 109.918 173.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.07 136.45 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.417 1.087 . . . . 0.0 112.056 -169.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 18.0 t -120.62 160.26 23.61 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.905 1.682 . . . . 0.0 111.442 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 82.1 p -137.72 -0.4 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -174.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.34 -11.6 5.8 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.613 1.102 . . . . 0.0 115.004 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.2 p -157.6 158.67 36.0 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.235 -1.156 . . . . 0.0 113.513 -173.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 29.6 t-105 -60.69 140.11 92.95 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 126.309 1.843 . . . . 0.0 114.991 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -96.1 176.98 9.71 Favored 'Cis proline' 0 CA--C 1.546 1.114 0 CA-C-N 119.969 1.025 . . . . 0.0 111.281 -11.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.9 mp -69.35 168.14 14.98 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.133 0.968 . . . . 0.0 111.096 169.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -114.71 164.29 14.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.158 1.383 . . . . 0.0 109.434 169.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -140.46 149.83 43.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.362 1.065 . . . . 0.0 112.484 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.1 t -145.62 150.28 36.06 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.149 1.38 . . . . 0.0 111.181 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.85 132.19 46.35 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.781 -0.574 . . . . 0.0 109.478 169.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.91 66.37 0.07 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.472 2.309 . . . . 0.0 115.939 176.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.76 7.81 4.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 175.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -57.74 -31.28 66.32 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 116.31 1.967 . . . . 0.0 116.31 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.9 p -99.09 -6.33 28.59 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -63.64 -35.77 18.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 117.277 2.325 . . . . 0.0 117.277 -169.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo . . . . . 0 C--O 1.25 1.094 0 C-N-CA 124.111 3.207 . . . . 0.0 115.307 177.865 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 . . . . . 0 CA--C 1.541 0.607 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -71.12 -41.11 70.95 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.836 1.198 . . . . 0.0 112.767 176.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 46.4 t -66.96 -45.01 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.693 0.797 . . . . 0.0 109.825 173.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.69 90.83 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.105 0.962 . . . . 0.0 112.512 176.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -63.11 -49.28 75.03 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.749 1.159 . . . . 0.0 111.671 172.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.2 m -57.77 -52.41 65.59 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.136 0.574 . . . . 0.0 110.584 177.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -65.48 -30.75 71.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.685 1.194 . . . . 0.0 113.728 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.35 -48.75 78.43 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.743 1.61 . . . . 0.0 110.778 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -66.41 -38.94 88.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.887 1.275 . . . . 0.0 111.513 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.53 -46.06 87.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.612 0.765 . . . . 0.0 112.191 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.3 m -57.56 -40.08 78.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.857 0.863 . . . . 0.0 111.27 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.06 -44.58 84.11 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.46 -43.51 97.15 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.357 -0.839 . . . . 0.0 111.913 174.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -62.15 -45.56 92.91 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.948 1.699 . . . . 0.0 111.515 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -59.13 -47.46 85.21 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.463 1.105 . . . . 0.0 112.242 170.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.5 m -58.24 -41.56 84.45 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 118.871 0.759 . . . . 0.0 110.725 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.32 -41.02 94.44 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.051 -1.031 . . . . 0.0 113.715 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.23 -32.78 74.5 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.148 -0.97 . . . . 0.0 113.094 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.3 tp -74.08 -35.11 64.2 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.848 1.259 . . . . 0.0 111.602 174.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.53 -46.25 90.75 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.994 -1.066 . . . . 0.0 111.067 169.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 tp -51.98 -47.45 64.85 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.322 1.449 . . . . 0.0 111.262 169.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.43 85.93 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.9 mt -66.05 -47.95 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.411 1.005 . . . . 0.0 110.659 174.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -59.83 -39.24 84.4 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.807 -0.558 . . . . 0.0 112.007 175.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -69.17 -38.72 78.86 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.362 -0.836 . . . . 0.0 112.391 175.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.26 73.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.449 1.022 . . . . 0.0 112.712 174.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.08 -20.41 55.79 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.687 0.676 . . . . 0.0 112.551 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.48 -27.19 14.17 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.613 1.165 . . . . 0.0 113.702 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.7 m -89.83 -14.03 35.28 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -169.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.34 -1.36 81.67 Favored Glycine 0 CA--C 1.542 1.723 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -140.83 149.98 58.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 127.861 2.464 . . . . 0.0 107.25 172.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -45.95 164.67 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 124.305 3.337 . . . . 0.0 115.528 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.8 t -123.12 159.3 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.431 1.893 . . . . 0.0 108.353 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.35 -178.79 32.71 Favored Glycine 0 N--CA 1.465 0.574 0 O-C-N 120.721 -1.237 . . . . 0.0 115.402 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.8 mt -131.27 111.95 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.42 1.088 . . . . 0.0 110.333 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -83.36 78.29 9.66 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.206 1.803 . . . . 0.0 110.269 175.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -64.99 120.36 12.46 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 168.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 t -125.99 -179.6 4.77 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.25 1.42 . . . . 0.0 113.079 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.34 -24.78 68.0 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -169.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.1 m -135.08 -9.72 2.29 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -175.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -161.16 -175.68 5.01 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.959 2.104 . . . . 0.0 109.365 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -136.6 151.48 49.38 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.302 1.041 . . . . 0.0 109.583 169.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -141.08 151.34 43.92 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.2 mm -76.65 137.33 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 169.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.1 mtm -128.89 150.4 50.37 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.049 1.34 . . . . 0.0 111.371 175.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.65 163.28 51.74 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 126.98 2.112 . . . . 0.0 111.261 -168.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -54.49 160.95 6.24 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 124.085 3.19 . . . . 0.0 114.825 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -120.22 -136.35 5.17 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.587 1.089 . . . . 0.0 113.715 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -46.54 -35.79 6.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 126.37 1.868 . . . . 0.0 114.68 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 t -146.45 142.13 17.09 Favored Pre-proline 0 N--CA 1.47 0.572 0 C-N-CA 124.805 1.242 . . . . 0.0 111.696 174.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.6 -10.0 14.59 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.488 2.792 . . . . 0.0 112.55 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 t -71.13 -17.3 62.57 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.057 1.343 . . . . 0.0 114.157 -173.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.62 163.7 33.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.489 1.516 . . . . 0.0 111.611 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.0 t-105 -58.32 112.4 1.55 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.844 1.257 . . . . 0.0 111.911 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.1 tpt85 -157.04 143.18 17.96 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.699 1.599 . . . . 0.0 109.992 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -136.52 153.63 50.96 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.553 1.141 . . . . 0.0 112.81 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.4 t -150.3 140.33 13.86 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 128.079 2.552 . . . . 0.0 108.366 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.425 ' C ' ' H ' ' A' ' 65' ' ' GLN . 86.5 Cg_exo -51.46 145.32 29.1 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.474 2.116 . . . . 0.0 111.787 168.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.4 tp -66.44 12.7 0.06 Allowed 'General case' 0 CA--C 1.554 1.134 0 O-C-N 120.576 -1.328 . . . . 0.0 114.185 176.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.425 ' H ' ' C ' ' A' ' 63' ' ' PRO . 58.4 mt-30 -64.93 -7.77 12.9 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.998 -1.688 . . . . 0.0 113.576 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -57.46 -25.78 60.23 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.031 1.333 . . . . 0.0 112.122 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -137.21 -42.19 0.57 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.607 1.163 . . . . 0.0 112.964 170.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.35 48.3 1.01 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.014 1.325 . . . . 0.0 111.492 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.31 -34.66 10.88 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.707 1.603 . . . . 0.0 115.099 -169.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -123.92 13.5 9.16 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.743 2.017 . . . . 0.0 113.286 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -133.39 -5.16 2.97 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.242 1.417 . . . . 0.0 113.942 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.0 t -54.88 -34.29 62.83 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.263 1.025 . . . . 0.0 112.819 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -118.91 140.21 50.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.62 1.568 . . . . 0.0 112.506 178.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 23.83 -115.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 127.429 2.292 . . . . 0.0 114.152 -169.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.0 t70 54.41 29.92 11.84 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.351 1.46 . . . . 0.0 113.718 -169.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -115.85 -21.25 9.66 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.972 1.709 . . . . 0.0 113.21 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -141.6 170.65 15.33 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.952 1.301 . . . . 0.0 113.537 -175.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -143.0 8.24 1.65 Allowed 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 169.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.36 9.41 1.08 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 125.053 1.341 . . . . 0.0 114.213 -175.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.96 160.86 23.96 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.414 -1.429 . . . . 0.0 112.097 -169.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.6 m -128.78 134.47 48.4 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 126.759 2.024 . . . . 0.0 108.825 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -104.61 146.98 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 124.292 1.037 . . . . 0.0 110.226 -173.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -138.18 160.9 38.21 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.663 1.985 . . . . 0.0 109.81 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.97 160.84 28.93 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.664 1.186 . . . . 0.0 112.424 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -148.0 130.58 7.8 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.948 2.099 . . . . 0.0 108.284 176.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -79.0 -5.21 37.48 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 CA-C-N 121.671 1.633 . . . . 0.0 113.146 -10.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -65.99 -178.83 0.65 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.177 1.791 . . . . 0.0 112.724 176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.6 138.87 25.44 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 124.485 1.114 . . . . 0.0 112.897 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.72 99.88 1.2 Allowed 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.72 2.947 . . . . 0.0 109.704 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -156.46 154.39 30.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.663 1.185 . . . . 0.0 111.67 -169.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -76.06 53.08 0.76 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.925 1.69 . . . . 0.0 113.51 -171.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 84.0 p -67.38 -12.85 61.25 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.426 1.49 . . . . 0.0 114.119 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.9 25.81 14.98 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.406 1.883 . . . . 0.0 113.2 -175.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -144.18 164.42 29.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 125.419 1.488 . . . . 0.0 110.299 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -64.84 141.22 70.57 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 CA-C-N 120.057 1.056 . . . . 0.0 111.951 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -89.21 -25.83 21.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.931 0.892 . . . . 0.0 110.96 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.5 t -123.98 134.91 65.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.691 1.996 . . . . 0.0 108.324 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.3 t -132.82 145.48 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.972 0.909 . . . . 0.0 111.36 -171.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.0 120.13 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.377 2.671 . . . . 0.0 108.422 -169.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.2 mt -85.54 164.21 17.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.253 1.025 . . . . 0.0 112.058 177.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.02 -13.79 13.22 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -175.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -120.32 9.79 11.1 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.48 1.512 . . . . 0.0 113.354 -177.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.96 9.02 58.71 Favored Glycine 0 CA--C 1.533 1.212 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 174.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.13 136.49 41.09 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.815 1.307 . . . . 0.0 108.438 169.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.21 142.59 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.915 1.286 . . . . 0.0 109.169 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.6 p -54.02 127.31 54.04 Favored Pre-proline 0 N--CA 1.472 0.655 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.232 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.34 122.78 8.98 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.535 2.157 . . . . 0.0 111.423 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.514 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 3.3 p90 -159.03 -179.27 7.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.925 2.09 . . . . 0.0 110.594 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -140.85 99.39 3.6 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 172.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.4 tp -57.73 127.93 34.53 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.369 2.268 . . . . 0.0 109.418 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -125.58 150.53 47.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.059 1.344 . . . . 0.0 110.546 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.3 mtt -133.06 144.74 50.21 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.42 -176.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.61 147.62 43.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.32 1.448 . . . . 0.0 111.317 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -65.86 121.43 15.03 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.982 0.913 . . . . 0.0 110.506 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.62 -18.91 64.41 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 176.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -72.07 -65.51 2.35 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.611 1.1 . . . . 0.0 113.166 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 38.5 p -83.83 -26.1 29.8 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 83.87 -0.1 89.59 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.142 1.353 . . . . 0.0 113.874 -170.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -80.09 145.91 61.91 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-N 118.705 1.253 . . . . 0.0 112.403 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.39 151.24 80.63 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.932 2.421 . . . . 0.0 112.007 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.61 -47.47 1.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.827 1.651 . . . . 0.0 112.619 -169.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.416 HD22 HE21 ' A' ' 134' ' ' GLN . 8.0 tp -151.94 156.2 39.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.951 1.3 . . . . 0.0 109.813 -169.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -146.69 139.31 25.11 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.384 1.074 . . . . 0.0 109.149 174.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.0 131.65 56.88 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.134 1.774 . . . . 0.0 108.285 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.9 t -118.95 139.83 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.456 1.502 . . . . 0.0 111.214 -169.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.7 t -123.21 144.59 49.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.031 1.732 . . . . 0.0 111.255 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.0 m -129.42 8.77 5.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.724 1.21 . . . . 0.0 113.712 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.89 -12.8 4.47 Favored Glycine 0 CA--C 1.537 1.424 0 N-CA-C 115.71 1.044 . . . . 0.0 115.71 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 87.7 p -157.78 159.71 37.05 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.057 1.428 . . . . 0.0 114.128 -173.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 35.0 t-105 -60.67 139.9 92.93 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 127.068 2.147 . . . . 0.0 115.803 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -95.9 179.01 8.47 Favored 'Cis proline' 0 CA--C 1.547 1.168 0 CA-C-N 120.05 1.053 . . . . 0.0 110.828 -11.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -72.3 165.35 24.65 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.15 -0.969 . . . . 0.0 112.251 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -118.71 129.49 55.31 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.891 1.676 . . . . 0.0 111.58 -176.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.416 HE21 HD22 ' A' ' 122' ' ' LEU . 51.7 tt0 -92.61 143.96 25.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.375 1.87 . . . . 0.0 112.582 -169.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.3 t -150.39 159.34 44.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.195 1.798 . . . . 0.0 110.924 171.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -78.85 134.45 36.94 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.366 -0.834 . . . . 0.0 109.014 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.18 60.13 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.939 2.096 . . . . 0.0 115.589 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 39.4 ptt180 44.68 27.29 0.24 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.874 2.87 . . . . 0.0 117.405 -176.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -57.94 -30.42 65.95 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 40.7 p -79.87 -15.24 57.75 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 174.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -72.01 -39.3 6.65 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo . . . . . 0 C--O 1.25 1.103 0 C-N-CA 124.297 3.331 . . . . 0.0 115.222 176.047 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -66.11 -41.9 89.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.044 0.937 . . . . 0.0 112.432 171.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.02 -46.83 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 118.381 -0.819 . . . . 0.0 109.409 170.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.91 90.71 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.559 1.072 . . . . 0.0 113.028 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -61.82 -48.72 79.33 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.436 1.016 . . . . 0.0 111.818 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 m -57.66 -47.62 81.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.905 0.482 . . . . 0.0 111.12 176.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.72 -34.25 77.42 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.109 1.764 . . . . 0.0 112.424 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.82 -46.51 89.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.62 1.1 . . . . 0.0 111.534 169.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.61 -37.47 86.71 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.248 1.019 . . . . 0.0 111.663 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -65.44 -46.57 79.37 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.056 0.942 . . . . 0.0 112.238 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 84.8 m -60.34 -35.06 74.78 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.326 1.05 . . . . 0.0 111.803 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.55 73.4 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.025 1.33 . . . . 0.0 113.48 174.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -44.05 97.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.6 -0.687 . . . . 0.0 111.518 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -59.79 -48.54 81.28 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.6 1.16 . . . . 0.0 111.854 173.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -58.39 -44.6 89.0 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.134 0.879 . . . . 0.0 112.183 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 29.8 m -61.25 -43.03 99.55 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.493 0.588 . . . . 0.0 110.797 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.45 93.67 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.073 -1.017 . . . . 0.0 113.429 172.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.62 76.33 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.123 0.969 . . . . 0.0 112.779 175.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.3 tp -72.94 -34.64 66.69 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.756 1.223 . . . . 0.0 111.537 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.33 -45.33 93.72 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.049 -1.032 . . . . 0.0 110.833 169.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.33 -45.78 55.13 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.869 1.668 . . . . 0.0 111.178 169.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.51 96.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.91 -48.67 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.836 0.744 . . . . 0.0 110.427 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.25 -29.15 69.66 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.572 1.149 . . . . 0.0 113.167 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -87.01 -37.53 17.41 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.068 0.947 . . . . 0.0 113.082 177.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.22 -33.23 71.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.306 1.042 . . . . 0.0 113.623 -177.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 t -74.17 -13.87 60.87 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.6 mt -110.26 -35.96 5.94 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 113.536 -173.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.3 p -70.24 -35.24 73.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.908 1.283 . . . . 0.0 113.703 -177.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.26 0.8 50.84 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.406 1.479 . . . . 0.0 114.699 -175.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -144.67 147.6 36.48 Favored Pre-proline 0 N--CA 1.473 0.68 0 C-N-CA 125.243 1.417 . . . . 0.0 110.08 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -46.78 152.71 1.57 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 122.608 2.205 . . . . 0.0 112.116 167.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.23 160.65 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.417 1.487 . . . . 0.0 108.455 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.66 175.97 28.57 Favored Glycine 0 CA--C 1.522 0.482 0 O-C-N 120.886 -1.134 . . . . 0.0 114.53 -176.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.4 mt -135.72 127.65 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.603 1.161 . . . . 0.0 108.728 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -99.95 130.66 46.15 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.272 1.829 . . . . 0.0 109.587 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -118.61 121.71 40.85 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.055 1.742 . . . . 0.0 107.919 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 p -115.34 -178.47 3.38 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.567 1.147 . . . . 0.0 113.112 -169.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -65.54 -13.54 59.15 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.2 m -139.1 -21.34 0.95 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -170.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -156.65 -172.71 4.17 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.844 1.258 . . . . 0.0 111.495 -178.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p90 -147.64 149.21 32.07 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.3 -0.875 . . . . 0.0 110.28 169.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 67.1 mtt-85 -146.86 145.63 29.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.289 1.435 . . . . 0.0 111.9 -171.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 14.3 mm -73.57 146.65 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.0 mtp -135.86 146.23 47.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.355 1.062 . . . . 0.0 111.483 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.9 m -140.14 165.49 30.21 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.703 1.601 . . . . 0.0 112.358 -169.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -59.79 -31.56 94.17 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.272 2.648 . . . . 0.0 114.642 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 45.33 -83.53 0.01 OUTLIER Glycine 0 CA--C 1.536 1.393 0 C-N-CA 127.719 2.58 . . . . 0.0 116.082 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -62.33 -39.56 93.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.955 1.302 . . . . 0.0 113.196 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.1 t -161.32 136.7 5.7 Favored Pre-proline 0 N--CA 1.478 0.93 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.45 -12.35 3.86 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.75 2.966 . . . . 0.0 112.995 169.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 m -70.21 -16.19 63.03 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -169.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -149.75 165.18 33.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.736 2.014 . . . . 0.0 109.556 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.6 t-105 -49.95 115.64 1.48 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.748 1.219 . . . . 0.0 112.002 178.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -150.55 149.89 30.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.263 1.425 . . . . 0.0 110.404 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -142.18 137.9 31.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.727 0.811 . . . . 0.0 112.72 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.3 t -141.91 135.23 14.3 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 126.964 2.106 . . . . 0.0 108.224 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.86 137.61 45.69 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.868 2.378 . . . . 0.0 111.644 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.1 tp -96.47 127.16 42.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.284 0.634 . . . . 0.0 111.375 -172.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -159.96 -24.25 0.07 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 169.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.22 -18.2 46.84 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -172.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -126.78 16.61 7.45 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.634 1.574 . . . . 0.0 113.097 174.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -129.46 4.08 5.11 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.237 1.815 . . . . 0.0 113.225 176.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.55 -65.19 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 130.389 3.475 . . . . 0.0 116.552 -177.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -152.99 4.89 0.35 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.298 1.839 . . . . 0.0 113.106 -176.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.81 36.37 0.21 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.016 1.726 . . . . 0.0 113.38 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.8 t -140.35 -157.1 0.74 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.049 2.54 . . . . 0.0 108.839 -173.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 43.78 43.81 5.24 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 171.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 56.78 21.81 6.35 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -176.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.09 -16.35 51.66 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 118.931 -2.356 . . . . 0.0 113.918 172.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.5 m0 -66.05 -18.82 65.59 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -170.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -140.44 170.7 15.31 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -172.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.77 15.7 2.32 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.485 1.514 . . . . 0.0 113.392 175.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -146.27 -0.91 0.75 Allowed 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 115.274 1.583 . . . . 0.0 115.274 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.9 mt -120.58 162.63 19.31 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -168.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.6 t -139.13 131.24 28.03 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 128.442 2.697 . . . . 0.0 106.359 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -106.97 147.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 123.644 0.778 . . . . 0.0 111.183 -169.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -133.38 156.69 47.21 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.513 1.925 . . . . 0.0 109.549 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.12 162.88 31.7 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.06 0.944 . . . . 0.0 111.909 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.52 142.09 11.03 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.897 1.679 . . . . 0.0 110.002 169.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -72.59 -7.76 16.29 Favored 'Cis proline' 0 CA--C 1.546 1.083 0 CA-C-N 120.737 1.299 . . . . 0.0 113.32 -9.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -65.18 175.29 1.68 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.229 1.412 . . . . 0.0 112.073 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.58 142.28 19.0 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.254 1.022 . . . . 0.0 113.027 -174.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.33 91.71 1.11 Allowed 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 124.1 3.2 . . . . 0.0 110.826 177.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -157.38 138.45 13.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 0.0 110.272 -170.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -60.89 86.76 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.408 1.083 . . . . 0.0 112.006 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.7 m -95.69 -2.16 48.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.782 1.633 . . . . 0.0 113.161 -169.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.43 18.39 3.45 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 126.877 2.071 . . . . 0.0 114.449 -177.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -158.43 162.43 26.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 126.876 2.07 . . . . 0.0 109.348 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.28 152.4 75.82 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 CA-C-N 120.178 1.099 . . . . 0.0 110.441 169.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -102.85 -44.58 5.23 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.479 0.312 . . . . 0.0 110.289 170.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.0 t -74.85 132.8 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.864 0.866 . . . . 0.0 109.183 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.2 t -134.37 144.81 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.814 0.846 . . . . 0.0 110.796 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.4 mp -130.45 122.31 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 127.749 2.42 . . . . 0.0 109.46 -169.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.2 mt -87.92 159.75 18.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.997 0.904 . . . . 0.0 111.623 174.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.05 -27.57 63.71 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.127 1.371 . . . . 0.0 114.509 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -84.74 -5.18 59.31 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.088 1.355 . . . . 0.0 113.431 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.39 12.14 61.7 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.217 0.913 . . . . 0.0 114.61 -176.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -76.89 136.38 38.84 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 118.482 1.141 . . . . 0.0 108.734 169.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -130.01 148.32 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.054 1.341 . . . . 0.0 109.431 -172.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 p -51.49 124.06 24.01 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.047 0.939 . . . . 0.0 111.908 169.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -74.03 92.69 0.89 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.151 2.567 . . . . 0.0 111.6 177.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -134.34 -178.09 4.89 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.258 1.823 . . . . 0.0 112.093 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 m -141.68 147.63 37.79 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.665 0.786 . . . . 0.0 111.259 169.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.5 133.01 52.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.993 2.117 . . . . 0.0 108.438 -176.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -122.14 147.19 46.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.119 -176.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 52.3 mtt -123.85 129.5 51.11 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.983 1.313 . . . . 0.0 109.761 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.9 143.6 51.23 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.896 1.678 . . . . 0.0 111.061 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -53.49 124.18 14.15 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.525 1.13 . . . . 0.0 111.566 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.54 -20.6 56.75 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -112.07 -48.62 0.65 Allowed Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.773 1.177 . . . . 0.0 113.214 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.8 m -71.87 -22.02 61.58 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.13 0.965 . . . . 0.0 112.288 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 68.14 35.86 84.26 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.235 0.921 . . . . 0.0 113.49 177.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -133.06 132.72 22.48 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.422 1.489 . . . . 0.0 110.887 -169.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -53.11 145.06 44.32 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 124.051 3.167 . . . . 0.0 115.0 177.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -34.08 4.09 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.736 1.215 . . . . 0.0 111.44 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -154.4 157.58 38.74 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 111.997 -168.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 7.4 m -143.94 147.8 34.46 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.301 1.84 . . . . 0.0 109.403 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.6 mp -119.42 142.17 48.45 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 126.161 1.785 . . . . 0.0 108.784 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 40.0 t -135.11 134.4 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.665 0.786 . . . . 0.0 111.702 -169.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -108.86 161.29 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.958 1.303 . . . . 0.0 112.137 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.5 p -133.78 2.07 3.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.885 1.674 . . . . 0.0 113.766 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 121.56 -8.82 10.1 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.121 1.343 . . . . 0.0 114.503 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.4 p -155.65 159.38 39.54 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 118.59 1.195 . . . . 0.0 113.75 -174.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.8 t-105 -60.9 138.73 93.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.852 2.061 . . . . 0.0 115.732 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.6 175.55 10.3 Favored 'Cis proline' 0 CA--C 1.546 1.11 0 CA-C-N 119.926 1.009 . . . . 0.0 110.717 -11.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.0 154.31 42.11 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 122.203 1.001 . . . . 0.0 110.718 169.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -79.05 168.11 20.12 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.311 1.445 . . . . 0.0 109.047 169.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -144.42 130.63 19.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.546 1.538 . . . . 0.0 109.968 -177.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.3 t -151.83 160.83 43.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.956 1.302 . . . . 0.0 112.173 -171.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.33 131.09 35.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.412 -0.805 . . . . 0.0 109.142 169.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.27 61.08 0.55 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.203 1.801 . . . . 0.0 115.541 173.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 57.29 12.37 1.37 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.997 2.519 . . . . 0.0 117.291 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -55.63 -35.05 65.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.575 2.065 . . . . 0.0 116.575 -169.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -80.59 -15.64 56.13 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -66.65 133.93 94.23 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.075 0.95 . . . . 0.0 112.182 -169.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 C--O 1.249 1.062 0 C-N-CA 123.446 2.764 . . . . 0.0 113.17 178.334 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 CA--C 1.544 0.741 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -72.82 -38.36 67.18 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.985 -1.072 . . . . 0.0 113.033 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.83 -38.9 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.94 170.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.73 -44.03 97.27 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.317 0.962 . . . . 0.0 112.422 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -57.75 -46.33 84.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.085 1.311 . . . . 0.0 111.843 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.8 m -61.41 -57.11 13.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.615 0.766 . . . . 0.0 111.255 178.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -63.11 -34.39 77.51 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.145 1.378 . . . . 0.0 113.076 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.65 -52.76 63.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.692 1.587 . . . . 0.0 111.719 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -64.22 -41.87 96.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.93 -54.25 44.49 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.307 1.443 . . . . 0.0 112.417 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.3 m -60.6 -36.43 78.55 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.892 1.277 . . . . 0.0 111.414 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.91 86.9 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.5 99.29 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.433 -0.792 . . . . 0.0 111.915 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -61.39 -46.32 90.67 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 111.858 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -62.73 -41.42 99.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.473 0.709 . . . . 0.0 112.107 173.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.1 m -59.38 -41.55 89.59 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.1 0.863 . . . . 0.0 111.322 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -40.65 96.05 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.77 -1.206 . . . . 0.0 113.399 172.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.68 -30.98 71.75 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 121.144 -0.972 . . . . 0.0 113.234 174.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.0 tp -72.1 -34.52 68.7 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.39 1.076 . . . . 0.0 111.84 172.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.18 -46.11 90.39 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.058 -1.026 . . . . 0.0 111.467 169.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.9 tp -53.98 -46.83 71.81 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.082 1.353 . . . . 0.0 111.982 170.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.45 -43.67 88.92 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 175.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.33 -46.62 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.805 0.842 . . . . 0.0 110.981 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -31.28 69.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.924 0.89 . . . . 0.0 112.931 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.9 mtt-85 -80.28 -37.98 31.73 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.24 1.016 . . . . 0.0 113.483 172.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.93 -34.47 78.18 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.524 1.056 . . . . 0.0 113.369 -175.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.1 t -70.29 -20.18 63.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.94 -31.25 9.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.199 1.4 . . . . 0.0 114.336 -174.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.7 m -82.13 -14.19 56.09 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.81 -3.94 81.51 Favored Glycine 0 CA--C 1.54 1.632 0 C-N-CA 124.22 0.914 . . . . 0.0 115.069 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -139.99 151.84 66.21 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 128.399 2.68 . . . . 0.0 106.765 170.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -45.63 166.65 0.06 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.358 3.372 . . . . 0.0 115.871 169.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -123.22 161.22 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 126.283 1.833 . . . . 0.0 108.235 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -165.28 -175.56 36.04 Favored Glycine 0 N--CA 1.469 0.889 0 CA-C-N 120.698 1.59 . . . . 0.0 115.964 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -127.41 122.54 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.783 1.233 . . . . 0.0 110.886 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -83.4 68.88 9.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.346 1.858 . . . . 0.0 111.322 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -59.65 119.95 8.56 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.466 -0.771 . . . . 0.0 110.219 169.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 84.1 p -141.33 13.52 2.18 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -169.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.76 -47.28 0.26 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.693 2.797 . . . . 0.0 115.169 -174.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.7 m -69.27 -26.95 65.01 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.63 1.172 . . . . 0.0 112.611 171.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.47 166.63 31.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.425 1.89 . . . . 0.0 111.043 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -155.96 99.39 1.97 Allowed 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.915 -0.491 . . . . 0.0 111.558 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -142.42 161.69 37.39 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -169.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.1 mm -71.47 142.52 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.528 1.131 . . . . 0.0 111.213 -171.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 81.0 mtp -128.4 146.67 50.72 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.796 1.638 . . . . 0.0 110.17 169.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 m -133.7 158.86 74.52 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 125.922 1.689 . . . . 0.0 111.26 -170.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -52.39 144.84 38.66 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.417 2.745 . . . . 0.0 115.503 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -101.62 -151.24 24.31 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 125.513 1.53 . . . . 0.0 113.087 175.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -55.42 -23.7 26.36 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.2 p -133.27 65.5 72.93 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 119.44 1.018 . . . . 0.0 113.204 -169.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -63.09 -17.19 58.93 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 123.04 2.493 . . . . 0.0 113.272 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -59.59 -15.36 18.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.427 1.491 . . . . 0.0 114.008 169.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.85 -87.39 0.2 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.62 1.168 . . . . 0.0 111.947 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -162.88 110.08 1.23 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.435 1.094 . . . . 0.0 111.874 -171.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.58 151.29 29.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.211 1.004 . . . . 0.0 110.11 169.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -138.69 150.5 46.26 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -171.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.8 t -143.4 138.96 15.96 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 126.957 2.103 . . . . 0.0 108.686 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.93 145.82 90.63 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.592 2.194 . . . . 0.0 111.304 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.42 45.46 0.23 Allowed 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -170.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -58.01 -20.76 41.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 119.635 -1.915 . . . . 0.0 113.841 172.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -59.42 -18.84 42.56 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.245 1.018 . . . . 0.0 113.686 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -130.69 -35.27 1.47 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.2 1.0 . . . . 0.0 113.498 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.13 -8.19 59.29 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 177.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.14 -60.29 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 129.436 3.095 . . . . 0.0 116.158 -173.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -148.03 -0.55 0.6 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.431 1.892 . . . . 0.0 112.898 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -92.23 0.49 57.46 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.674 -1.266 . . . . 0.0 113.415 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.2 p -64.57 13.89 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 128.456 2.702 . . . . 0.0 117.28 -172.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -154.44 42.82 0.51 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.557 1.543 . . . . 0.0 111.717 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -136.59 163.2 31.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.562 1.545 . . . . 0.0 112.878 -173.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -72.7 -177.42 2.3 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.782 0.833 . . . . 0.0 110.78 168.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -120.45 -6.83 9.77 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -150.64 -168.66 3.17 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -168.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -125.22 2.67 7.85 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.458 1.903 . . . . 0.0 114.382 -175.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -150.12 -4.33 0.36 Allowed 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -169.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.4 mt -105.84 167.91 9.47 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.707 -1.246 . . . . 0.0 113.139 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.7 t -140.76 136.59 32.68 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.427 2.291 . . . . 0.0 107.83 169.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.72 145.36 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.47 1.108 . . . . 0.0 111.272 -169.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -137.76 157.56 46.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.239 1.816 . . . . 0.0 110.142 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 tt -151.22 146.01 25.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.9 0.88 . . . . 0.0 112.089 -171.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -151.69 150.88 27.44 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.579 1.552 . . . . 0.0 111.125 169.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -80.04 -13.12 35.62 Favored 'Cis proline' 0 CA--C 1.543 0.943 0 CA-C-N 120.198 1.107 . . . . 0.0 114.451 -0.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -64.19 144.23 57.29 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.948 0.88 . . . . 0.0 113.234 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -62.49 128.87 92.08 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.539 1.536 . . . . 0.0 112.008 170.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.59 57.58 6.15 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 123.768 2.979 . . . . 0.0 109.673 169.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.39 150.0 26.45 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.039 1.336 . . . . 0.0 113.369 -169.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -74.17 47.98 0.3 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.859 1.664 . . . . 0.0 112.579 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.1 m -67.96 -5.59 17.9 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.942 1.697 . . . . 0.0 115.383 -172.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 56.31 27.83 12.47 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 126.157 1.783 . . . . 0.0 113.516 -174.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -146.9 163.12 30.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 109.3 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.75 147.54 85.79 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 CA-C-N 120.085 1.066 . . . . 0.0 111.867 169.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -95.3 -50.47 5.01 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.686 1.194 . . . . 0.0 109.806 170.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 68.3 t -89.66 136.4 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.371 1.468 . . . . 0.0 108.15 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 48.8 t -135.16 143.57 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-O 122.147 0.975 . . . . 0.0 111.947 -171.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -117.19 111.03 33.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 128.582 2.753 . . . . 0.0 107.639 -176.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.15 153.07 36.48 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.134 0.973 . . . . 0.0 109.81 177.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.82 -21.93 44.94 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.28 -11.4 59.9 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.275 1.43 . . . . 0.0 113.573 176.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.48 42.67 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.499 1.047 . . . . 0.0 114.187 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.69 147.44 29.58 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.981 1.312 . . . . 0.0 108.103 173.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -121.97 150.88 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.693 0.797 . . . . 0.0 110.585 -168.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.3 p -56.78 130.52 78.18 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.693 169.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -74.97 134.08 17.42 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.34 2.027 . . . . 0.0 112.201 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.433 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 14.5 p90 -163.92 177.28 8.68 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.693 1.997 . . . . 0.0 111.346 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.4 p -138.54 148.49 44.31 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.015 0.912 . . . . 0.0 110.646 169.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 tp -135.81 130.19 33.6 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.835 2.054 . . . . 0.0 108.089 -169.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -121.2 150.25 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.007 1.323 . . . . 0.0 110.363 -173.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 55.3 mtt -127.53 139.66 52.63 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 125.561 1.545 . . . . 0.0 108.669 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -136.83 151.39 49.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.293 1.437 . . . . 0.0 111.11 -177.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -61.73 119.8 9.41 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.365 1.066 . . . . 0.0 109.685 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.1 -19.4 61.42 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -174.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -101.66 -45.02 1.86 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 124.073 0.844 . . . . 0.0 113.609 -177.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.6 p -80.29 -27.82 38.42 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.707 1.254 . . . . 0.0 112.858 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 79.75 0.86 85.99 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 125.119 1.342 . . . . 0.0 113.928 -172.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -75.9 138.42 69.45 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 118.564 1.182 . . . . 0.0 111.638 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.25 154.59 72.86 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.566 2.177 . . . . 0.0 111.798 175.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.25 -51.32 1.19 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.983 1.713 . . . . 0.0 112.06 -169.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.82 153.12 40.55 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 126.847 2.059 . . . . 0.0 108.426 -169.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 4.9 m -143.97 136.84 27.28 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.539 0.736 . . . . 0.0 109.506 172.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.1 mp -116.55 143.78 45.18 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.819 2.448 . . . . 0.0 108.096 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 24.0 t -141.44 134.1 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.901 0.48 . . . . 0.0 111.911 -171.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.433 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.7 t -112.72 114.64 27.31 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.943 1.697 . . . . 0.0 110.305 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.4 p -75.34 -13.2 60.4 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.935 1.294 . . . . 0.0 114.296 174.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 128.21 0.62 6.36 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.414 1.483 . . . . 0.0 114.339 -175.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 19.5 m -156.56 156.06 32.97 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.428 -1.631 . . . . 0.0 112.996 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 30.3 t-105 -60.09 140.15 90.87 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 125.939 1.696 . . . . 0.0 115.344 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -94.29 176.55 12.33 Favored 'Cis proline' 0 CA--C 1.546 1.089 0 CA-C-N 119.932 1.011 . . . . 0.0 110.751 -11.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.1 mp -67.87 149.52 49.73 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.069 -1.019 . . . . 0.0 110.746 169.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -77.87 170.7 16.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.982 1.313 . . . . 0.0 110.282 170.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -140.01 144.45 36.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.781 1.632 . . . . 0.0 111.394 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.7 t -153.42 151.55 30.02 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.889 1.275 . . . . 0.0 111.7 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.88 134.22 50.48 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.588 -0.695 . . . . 0.0 109.841 170.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.68 67.87 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 127.423 2.289 . . . . 0.0 116.579 171.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.3 mtm105 55.7 19.65 3.51 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.27 -17.52 12.24 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -177.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 8.3 t -134.09 28.34 3.8 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.022 1.329 . . . . 0.0 113.334 169.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.66 71.23 71.03 Favored Pre-proline 0 N--CA 1.481 1.12 0 C-N-CA 125.282 1.433 . . . . 0.0 110.677 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo . . . . . 0 C--O 1.251 1.167 1 C-N-CA 125.507 4.138 . . . . 0.0 116.048 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.58 -40.13 80.66 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.107 0.867 . . . . 0.0 112.316 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.46 -46.4 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.253 0.621 . . . . 0.0 109.957 174.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.22 87.38 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.731 0.696 . . . . 0.0 112.37 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -63.63 -46.42 85.76 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.204 0.911 . . . . 0.0 112.219 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.6 m -56.72 -49.77 74.19 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.932 175.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -67.47 -28.57 67.97 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.001 -1.0 . . . . 0.0 113.615 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.52 -48.09 78.99 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 120.711 1.596 . . . . 0.0 111.37 171.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -67.74 -40.64 84.14 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.829 1.252 . . . . 0.0 111.431 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.75 -38.65 80.28 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.697 0.799 . . . . 0.0 113.038 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.5 m -69.71 -34.44 73.9 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 120.117 -1.614 . . . . 0.0 111.853 175.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.65 91.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 170.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.29 92.94 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 112.06 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -64.49 -45.08 88.84 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.016 0.926 . . . . 0.0 112.328 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -62.76 -40.35 97.0 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.195 0.598 . . . . 0.0 112.342 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -60.86 -44.08 97.49 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.796 0.726 . . . . 0.0 110.795 175.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.75 98.29 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.686 -1.259 . . . . 0.0 113.391 172.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.49 76.15 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.14 -0.975 . . . . 0.0 113.097 175.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.1 tp -73.13 -31.74 64.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.439 1.095 . . . . 0.0 111.818 173.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -62.97 -44.31 96.39 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.935 -1.103 . . . . 0.0 110.864 169.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.15 -44.64 67.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.376 1.47 . . . . 0.0 111.321 169.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.28 97.15 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.2 mt -64.14 -45.0 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.202 1.001 . . . . 0.0 111.099 174.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.43 -43.52 75.44 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.803 0.841 . . . . 0.0 112.1 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.73 -31.77 61.92 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 178.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.8 89.7 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.414 1.007 . . . . 0.0 113.191 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -76.08 -24.26 55.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.12 -31.11 13.7 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -174.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.2 p -89.5 -14.52 35.07 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -169.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.23 6.53 78.27 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 170.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.62 151.71 54.51 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.987 2.115 . . . . 0.0 107.596 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -46.88 149.31 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 121.98 1.787 . . . . 0.0 111.652 167.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.19 164.93 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.323 1.849 . . . . 0.0 108.486 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.29 -178.68 30.68 Favored Glycine 0 C--N 1.332 0.308 0 O-C-N 120.762 -1.211 . . . . 0.0 115.404 -174.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.6 mt -135.6 120.88 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.564 1.146 . . . . 0.0 108.543 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -89.97 141.89 28.23 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 126.156 1.783 . . . . 0.0 110.861 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -140.07 130.23 25.06 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.137 1.775 . . . . 0.0 109.449 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 t -132.55 179.66 6.0 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.233 1.413 . . . . 0.0 111.039 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -61.85 -14.95 38.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -169.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 -8.42 0.92 Allowed 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 -178.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.5 164.52 36.08 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.778 1.172 . . . . 0.0 113.248 -177.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -149.67 156.22 41.52 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.269 1.828 . . . . 0.0 112.006 -175.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -161.26 148.0 14.73 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.727 1.611 . . . . 0.0 111.342 -175.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.9 mm -68.23 147.68 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 124.411 1.085 . . . . 0.0 109.566 172.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 44.7 mtp -135.75 150.67 49.58 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.474 -1.391 . . . . 0.0 112.466 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 9.4 m -144.06 168.03 13.67 Favored Pre-proline 0 N--CA 1.478 0.969 0 C-N-CA 126.219 1.808 . . . . 0.0 111.736 -169.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -57.53 -33.74 96.95 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.821 2.347 . . . . 0.0 114.089 171.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.46 -50.27 0.61 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 127.47 2.462 . . . . 0.0 116.673 170.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -137.72 -26.52 0.96 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.342 1.457 . . . . 0.0 114.578 -170.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.0 t -148.84 74.94 10.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 123.8 0.84 . . . . 0.0 112.646 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -63.35 -11.5 25.92 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.996 2.464 . . . . 0.0 113.624 170.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.2 m -60.08 -16.89 35.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.538 1.935 . . . . 0.0 114.662 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.01 171.01 15.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.133 1.773 . . . . 0.0 110.472 175.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.3 t-105 -62.8 112.39 2.52 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.366 -0.834 . . . . 0.0 111.145 173.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.434 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 4.6 tpm_? -150.65 157.29 42.8 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.852 1.261 . . . . 0.0 110.98 174.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.434 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 85.4 m95 -139.19 138.46 36.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.207 1.403 . . . . 0.0 111.945 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.77 138.86 17.57 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 126.966 2.106 . . . . 0.0 107.795 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.08 128.74 22.49 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.84 2.36 . . . . 0.0 111.183 175.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.3 tp -76.17 78.8 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.366 1.066 . . . . 0.0 111.133 -176.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -91.3 5.46 49.12 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.32 1.048 . . . . 0.0 112.24 171.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -50.11 110.54 0.41 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.728 2.011 . . . . 0.0 111.966 173.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.0 t70 57.95 -29.71 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.533 2.733 . . . . 0.0 116.385 -171.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.38 -18.29 64.43 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.346 1.859 . . . . 0.0 113.644 175.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.73 -178.01 0.14 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.329 2.652 . . . . 0.0 115.653 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -72.8 23.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.967 1.707 . . . . 0.0 114.619 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.31 7.18 5.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.896 2.078 . . . . 0.0 111.216 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 73.3 p -79.83 -23.53 41.96 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.357 1.463 . . . . 0.0 114.084 -177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -74.08 123.19 23.93 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.248 1.019 . . . . 0.0 109.207 169.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -147.43 -179.48 6.88 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.098 0.959 . . . . 0.0 112.801 -169.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.91 25.51 10.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.05 2.14 . . . . 0.0 112.579 -177.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER 58.17 -44.66 0.05 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 130.131 3.372 . . . . 0.0 118.413 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -156.55 -167.91 2.54 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.334 0.97 . . . . 0.0 113.409 -169.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -128.09 -14.14 4.97 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.785 2.034 . . . . 0.0 113.121 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -120.42 5.03 10.69 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.59 1.556 . . . . 0.0 111.904 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -139.26 141.63 37.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.531 1.532 . . . . 0.0 110.064 -169.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 88.9 p -137.14 154.91 50.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.678 1.991 . . . . 0.0 111.39 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.07 147.6 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.107 1.363 . . . . 0.0 112.173 -169.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -139.68 162.28 35.49 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.898 2.079 . . . . 0.0 110.838 170.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.2 mt -141.14 155.95 46.02 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.592 1.157 . . . . 0.0 113.932 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.69 155.14 22.18 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.893 2.077 . . . . 0.0 110.325 169.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.13 -9.16 18.38 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 CA-C-N 120.469 1.203 . . . . 0.0 113.207 -9.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.16 172.01 1.59 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.613 1.565 . . . . 0.0 113.361 173.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -126.31 121.66 23.81 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.368 1.867 . . . . 0.0 110.932 -170.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.5 98.3 0.94 Allowed 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.698 2.265 . . . . 0.0 110.475 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -154.35 157.23 38.27 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.483 1.513 . . . . 0.0 111.301 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -70.52 47.0 0.09 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 128.219 2.608 . . . . 0.0 114.358 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.6 t -65.05 160.96 19.8 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.101 2.16 . . . . 0.0 114.303 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -63.81 -13.79 47.4 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.628 1.571 . . . . 0.0 112.727 169.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -131.04 162.78 53.52 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.271 1.428 . . . . 0.0 112.571 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -70.81 164.56 35.13 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.179 2.586 . . . . 0.0 112.416 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -95.57 -21.94 17.94 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.619 1.568 . . . . 0.0 112.398 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.1 t -114.11 143.26 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.547 1.139 . . . . 0.0 108.875 169.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.2 t -136.18 137.75 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 110.326 -178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -125.25 117.97 51.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 128.679 2.791 . . . . 0.0 106.925 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.15 148.58 35.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.385 0.612 . . . . 0.0 110.224 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.9 -22.79 60.16 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -70.02 -22.82 63.07 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.08 1.752 . . . . 0.0 113.458 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 104.09 5.13 44.17 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.98 1.276 . . . . 0.0 115.056 -179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -90.55 154.53 19.54 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.81 1.644 . . . . 0.0 109.869 169.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 1.2 mp -129.76 142.7 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 124.696 1.198 . . . . 0.0 109.605 -169.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t -56.17 140.43 70.98 Favored Pre-proline 0 N--CA 1.477 0.875 0 C-N-CA 123.541 0.736 . . . . 0.0 112.642 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -64.73 131.18 28.45 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.765 2.31 . . . . 0.0 112.601 169.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -161.52 173.57 14.63 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.785 1.634 . . . . 0.0 111.364 170.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.3 t -134.28 135.55 42.94 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.07 0.948 . . . . 0.0 110.194 169.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.1 tp -128.64 116.0 18.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 128.06 2.544 . . . . 0.0 108.467 -169.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -105.35 147.06 28.58 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.752 1.221 . . . . 0.0 110.444 -173.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 51.1 mtt -128.38 130.56 47.86 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.849 1.66 . . . . 0.0 109.753 -176.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -134.26 152.29 51.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.773 1.229 . . . . 0.0 112.29 -169.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -64.93 110.4 2.43 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.116 1.367 . . . . 0.0 110.528 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.56 -15.83 59.12 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.69 -20.49 59.75 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.721 1.153 . . . . 0.0 114.384 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -132.03 -21.28 2.4 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.987 1.393 . . . . 0.0 114.424 -171.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 86.78 -1.09 86.88 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 125.599 1.571 . . . . 0.0 114.4 -176.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -83.97 131.51 51.2 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.583 1.191 . . . . 0.0 112.517 -171.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 143.47 40.48 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.531 2.821 . . . . 0.0 113.568 169.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.11 -44.66 1.15 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.686 1.594 . . . . 0.0 112.151 -172.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 tt -149.94 155.21 39.58 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.833 1.653 . . . . 0.0 108.172 -178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 85.5 m -144.04 151.11 39.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.233 -1.542 . . . . 0.0 109.505 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 78.1 mt -128.11 133.59 49.03 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 127.295 2.238 . . . . 0.0 108.323 -169.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.5 t -133.58 135.92 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 122.982 0.513 . . . . 0.0 111.995 -169.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 34.0 t -119.41 141.0 49.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.945 1.698 . . . . 0.0 110.443 175.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -127.94 2.28 5.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.193 1.397 . . . . 0.0 113.833 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 152.59 -20.14 0.8 Allowed Glycine 0 CA--C 1.535 1.317 0 N-CA-C 115.852 1.101 . . . . 0.0 115.852 175.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 4.9 t -156.26 165.27 36.87 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.771 1.785 . . . . 0.0 114.345 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 -63.86 143.66 98.1 Favored Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 127.738 2.415 . . . . 0.0 115.333 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -91.44 177.26 15.84 Favored 'Cis proline' 0 CA--C 1.546 1.102 0 CA-C-N 119.479 0.85 . . . . 0.0 110.472 -11.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.3 156.26 38.07 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.061 -1.024 . . . . 0.0 111.66 169.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -101.98 129.02 48.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.445 1.498 . . . . 0.0 110.858 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -84.58 149.62 25.76 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.844 1.258 . . . . 0.0 112.048 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.0 t -149.77 146.17 27.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.028 1.731 . . . . 0.0 109.623 169.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.28 136.49 42.64 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.097 -1.002 . . . . 0.0 109.814 170.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 61.07 0.11 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.365 2.266 . . . . 0.0 115.427 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 11.6 ptm180 44.7 27.95 0.3 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.128 2.571 . . . . 0.0 117.763 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.76 -34.57 65.33 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.14 -4.1 58.56 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 174.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.37 48.67 0.51 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.25 1.42 . . . . 0.0 114.612 -170.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo . . . . . 0 C--O 1.249 1.058 0 C-N-CA 123.501 2.8 . . . . 0.0 113.173 179.555 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 . . . . . 0 CA--C 1.546 0.809 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -76.92 -3.72 40.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.035 1.334 . . . . 0.0 114.425 175.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.3 t -129.54 -35.67 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 126.021 1.729 . . . . 0.0 111.696 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.64 73.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.719 1.208 . . . . 0.0 113.563 -173.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -60.01 -52.31 65.92 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.591 1.087 . . . . 0.0 111.919 174.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.9 m -60.08 -44.45 94.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.985 0.914 . . . . 0.0 111.386 177.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -33.92 76.11 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.268 1.027 . . . . 0.0 112.866 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.07 -48.78 78.7 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.872 1.215 . . . . 0.0 111.302 170.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -62.47 -38.34 89.47 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.523 1.129 . . . . 0.0 111.913 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.22 -50.34 68.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.09 1.356 . . . . 0.0 111.932 170.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.8 m -62.52 -32.94 73.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.549 1.14 . . . . 0.0 111.389 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.8 80.22 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.596 1.158 . . . . 0.0 113.292 170.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.3 95.29 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.462 -0.774 . . . . 0.0 111.736 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.99 -47.37 86.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.111 1.364 . . . . 0.0 112.058 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.59 -42.2 98.52 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.698 0.799 . . . . 0.0 112.458 171.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 59.6 m -59.29 -40.79 87.26 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.558 -0.714 . . . . 0.0 111.283 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.99 92.52 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.808 -1.183 . . . . 0.0 113.374 172.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.19 -33.73 76.45 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.202 -0.936 . . . . 0.0 112.915 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -70.37 -35.26 73.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.554 1.142 . . . . 0.0 112.147 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.62 -44.32 96.58 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.076 -1.015 . . . . 0.0 111.723 170.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.2 tp -54.11 -46.48 72.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.148 1.379 . . . . 0.0 111.534 170.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.02 96.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.3 mt -62.51 -46.53 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.261 0.937 . . . . 0.0 110.806 173.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.38 -36.59 78.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.463 0.705 . . . . 0.0 112.599 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -73.69 -30.67 63.02 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.04 0.936 . . . . 0.0 113.14 174.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.05 -39.77 90.41 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.971 1.259 . . . . 0.0 114.083 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -68.23 -29.04 67.77 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.675 -0.641 . . . . 0.0 112.121 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.1 mt -79.87 -33.77 39.75 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.025 1.33 . . . . 0.0 113.055 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.8 m -75.39 -22.57 57.36 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -173.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.89 9.79 71.37 Favored Glycine 0 CA--C 1.541 1.706 0 C-N-CA 123.74 0.686 . . . . 0.0 114.434 -176.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -151.15 150.64 27.79 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 128.402 2.681 . . . . 0.0 107.592 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -47.66 149.95 4.5 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.508 2.139 . . . . 0.0 112.741 168.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -116.17 165.31 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 126.913 2.085 . . . . 0.0 108.714 -175.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -150.59 175.42 29.62 Favored Glycine 0 CA--C 1.52 0.371 0 O-C-N 121.024 -1.047 . . . . 0.0 115.508 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.6 mt -132.67 120.1 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 124.858 1.263 . . . . 0.0 108.316 178.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -81.86 146.03 30.06 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.306 1.442 . . . . 0.0 110.771 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -142.35 138.3 31.13 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.461 1.905 . . . . 0.0 110.587 174.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.8 p -129.6 -177.61 4.34 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.661 1.584 . . . . 0.0 112.09 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.09 -15.6 14.87 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.1 p -142.61 -11.06 0.81 Allowed 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.466 2.025 . . . . 0.0 116.466 -172.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -150.73 172.13 16.06 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.117 1.326 . . . . 0.0 113.816 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -141.72 158.61 43.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.136 1.774 . . . . 0.0 110.849 171.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -158.51 161.92 37.41 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 124.064 0.945 . . . . 0.0 112.916 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.7 mm -80.08 145.05 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.563 1.145 . . . . 0.0 108.849 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 70.2 mtp -135.81 143.38 45.14 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.209 1.003 . . . . 0.0 111.636 175.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.45 166.25 20.92 Favored Pre-proline 0 N--CA 1.483 1.192 0 C-N-CA 126.223 1.809 . . . . 0.0 111.177 -169.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.63 163.4 24.49 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.725 2.284 . . . . 0.0 113.285 171.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.41 -84.37 0.09 OUTLIER Glycine 0 N--CA 1.472 1.059 0 C-N-CA 123.86 0.743 . . . . 0.0 114.292 176.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 10.8 mmpt? -61.41 -31.31 71.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.712 0.805 . . . . 0.0 113.013 -176.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.7 t -158.0 140.67 10.6 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 124.456 1.103 . . . . 0.0 111.37 169.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -81.93 5.17 6.49 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 124.055 3.17 . . . . 0.0 112.52 169.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.2 m -62.56 -27.9 69.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -171.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -159.58 -49.74 0.05 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -148.23 -74.93 0.18 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -169.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -8.64 83.02 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 129.261 3.024 . . . . 0.0 116.454 -169.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -66.3 161.02 23.27 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.486 1.514 . . . . 0.0 114.693 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 41.4 t -140.36 142.34 29.16 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 128.262 2.625 . . . . 0.0 107.626 174.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.6 43.15 0.63 Allowed 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.854 3.702 . . . . 0.0 113.172 173.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.6 tp 52.92 -90.01 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.395 2.678 . . . . 0.0 112.665 -169.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 51.31 12.96 0.16 Allowed 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -66.61 -23.39 66.17 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.64 -1.287 . . . . 0.0 113.394 173.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -141.02 -38.96 0.41 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.753 1.621 . . . . 0.0 111.411 172.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 40.06 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.337 1.855 . . . . 0.0 112.579 169.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.88 -25.04 0.26 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 128.982 2.913 . . . . 0.0 118.787 -168.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -140.48 18.5 2.38 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.923 1.289 . . . . 0.0 111.76 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -146.03 18.38 1.42 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.756 1.223 . . . . 0.0 114.256 -169.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.4 p -68.28 -35.48 77.92 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.911 -1.118 . . . . 0.0 112.539 171.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -68.92 119.45 13.27 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.177 1.391 . . . . 0.0 111.229 170.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -138.14 179.94 6.15 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.009 1.724 . . . . 0.0 111.249 -170.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -136.91 178.74 6.84 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.817 2.047 . . . . 0.0 110.127 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -144.03 -46.79 0.27 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.42 163.24 21.29 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -169.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -143.03 -17.67 0.66 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.115 1.366 . . . . 0.0 114.445 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -132.06 14.87 4.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.649 1.58 . . . . 0.0 112.317 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.5 mt -118.87 162.42 18.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.538 1.135 . . . . 0.0 113.613 -175.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.8 t -138.23 133.87 33.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 128.008 2.523 . . . . 0.0 107.385 169.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.21 144.05 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 111.081 -169.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -137.79 149.78 46.67 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.99 1.716 . . . . 0.0 110.226 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.6 mt -126.72 151.82 47.65 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.419 1.088 . . . . 0.0 112.069 -172.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -143.61 128.0 9.45 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.654 1.582 . . . . 0.0 110.016 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -79.1 -3.99 37.06 Favored 'Cis proline' 0 CA--C 1.547 1.169 0 CA-C-N 120.544 1.23 . . . . 0.0 113.36 -9.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -62.26 157.39 19.67 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -169.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -89.2 124.11 65.54 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 126.849 2.06 . . . . 0.0 109.968 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.23 81.59 2.42 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.465 2.777 . . . . 0.0 110.962 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -152.66 149.17 28.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.958 1.303 . . . . 0.0 112.529 -171.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -80.73 54.63 2.17 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.111 -0.993 . . . . 0.0 112.574 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 m -70.89 31.36 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.749 2.42 . . . . 0.0 115.305 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 58.68 15.97 4.06 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.017 2.127 . . . . 0.0 114.575 -172.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -149.22 162.38 29.11 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 125.539 1.536 . . . . 0.0 111.634 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.23 159.59 40.37 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.552 2.168 . . . . 0.0 110.668 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -85.54 -54.49 4.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.793 0.837 . . . . 0.0 109.895 171.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.6 t -83.03 137.73 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.598 1.159 . . . . 0.0 109.254 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 78.8 t -130.5 142.6 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-O 121.621 0.724 . . . . 0.0 110.754 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -128.66 123.66 59.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 128.147 2.579 . . . . 0.0 109.343 -169.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.9 mt -80.77 159.52 25.15 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 111.452 170.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.11 -24.54 67.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.422 1.089 . . . . 0.0 113.636 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.16 -10.04 59.31 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.856 1.663 . . . . 0.0 113.502 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.04 4.56 59.98 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.603 1.097 . . . . 0.0 114.988 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -72.36 141.56 48.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.637 1.218 . . . . 0.0 109.042 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -130.73 153.36 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.938 1.295 . . . . 0.0 109.966 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.8 p -49.5 120.48 10.61 Favored Pre-proline 0 N--CA 1.473 0.686 0 C-N-CA 124.767 1.227 . . . . 0.0 111.76 169.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.9 76.67 3.66 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.824 3.016 . . . . 0.0 111.901 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -115.88 -178.53 3.42 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.994 1.718 . . . . 0.0 112.797 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.2 m -138.8 150.85 46.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.141 0.972 . . . . 0.0 112.231 169.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.62 137.92 40.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 127.063 2.145 . . . . 0.0 108.389 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.6 tt -127.88 147.16 50.45 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.18 1.392 . . . . 0.0 110.475 -174.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.8 mtt -125.2 130.4 52.05 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 125.047 1.339 . . . . 0.0 109.46 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.08 146.7 50.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.921 1.689 . . . . 0.0 111.426 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -46.85 121.55 3.68 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.802 1.241 . . . . 0.0 111.145 171.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.04 -31.37 51.21 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -170.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.07 -21.24 7.84 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.614 0.626 . . . . 0.0 114.183 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.8 m -108.11 -21.71 12.68 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.902 0.881 . . . . 0.0 112.664 -169.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.29 -3.31 78.16 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.663 1.125 . . . . 0.0 114.951 173.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -69.47 122.11 84.51 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 125.599 1.56 . . . . 0.0 111.281 175.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -55.35 141.95 80.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.027 2.484 . . . . 0.0 113.082 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.07 -39.05 5.4 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.955 0.902 . . . . 0.0 110.267 169.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -149.97 154.69 38.67 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.08 1.352 . . . . 0.0 110.763 -169.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 6.6 m -139.42 145.0 38.35 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.898 1.679 . . . . 0.0 108.339 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.4 mt -123.24 134.79 54.08 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 127.408 2.283 . . . . 0.0 107.632 -175.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 7.7 t -136.02 138.82 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.488 0.715 . . . . 0.0 111.619 -168.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.0 t -114.82 124.98 53.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.221 1.008 . . . . 0.0 111.626 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 74.6 p -74.39 -16.83 60.88 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.171 1.389 . . . . 0.0 114.262 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.78 -1.1 12.13 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 125.504 1.526 . . . . 0.0 113.741 -169.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.6 t -154.93 158.77 39.78 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.093 -1.239 . . . . 0.0 113.054 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -59.92 137.21 90.61 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.127 1.771 . . . . 0.0 114.83 -178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -96.59 176.78 9.35 Favored 'Cis proline' 0 CA--C 1.548 1.191 0 CA-C-N 120.04 1.05 . . . . 0.0 111.026 -11.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.56 163.66 20.72 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.127 -0.983 . . . . 0.0 111.069 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -117.62 134.21 55.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.626 1.57 . . . . 0.0 111.23 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -89.49 146.08 24.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 111.855 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 t -150.36 147.99 28.26 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.151 1.38 . . . . 0.0 111.018 169.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.1 mp -74.76 128.81 36.46 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.557 -0.714 . . . . 0.0 109.116 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.02 63.42 0.26 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.281 1.832 . . . . 0.0 115.841 175.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.05 2.29 1.02 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.895 2.478 . . . . 0.0 116.74 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -54.11 -27.15 31.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -169.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.99 5.49 12.86 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.568 1.547 . . . . 0.0 112.582 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -71.51 -47.72 12.76 Favored Pre-proline 0 N--CA 1.476 0.835 0 CA-C-O 116.568 -1.682 . . . . 0.0 114.761 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 C--O 1.25 1.124 0 C-N-CA 122.546 2.164 . . . . 0.0 113.11 -179.158 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.99 -40.64 87.43 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.66 -45.88 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.225 0.61 . . . . 0.0 109.774 173.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.3 -46.55 88.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.545 0.738 . . . . 0.0 112.565 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -58.39 -51.49 69.58 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.615 0.766 . . . . 0.0 112.331 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.9 m -57.86 -47.6 82.26 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.362 0.665 . . . . 0.0 111.319 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -70.5 -29.27 65.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.854 1.261 . . . . 0.0 113.912 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.7 -49.28 71.5 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 120.576 1.535 . . . . 0.0 110.461 171.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -62.48 -40.54 97.01 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.768 1.227 . . . . 0.0 111.936 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -63.23 -47.83 80.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.598 1.159 . . . . 0.0 112.298 172.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.2 m -57.7 -40.66 80.03 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.067 0.947 . . . . 0.0 111.204 175.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.36 78.41 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.09 -44.63 96.25 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.566 -0.709 . . . . 0.0 111.665 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -68.28 -39.33 82.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.632 0.773 . . . . 0.0 112.42 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.04 -45.24 91.25 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.69 0.677 . . . . 0.0 111.83 169.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -60.81 -42.99 98.73 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.858 0.754 . . . . 0.0 110.73 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.94 -40.18 94.65 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.957 -1.089 . . . . 0.0 113.538 172.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.96 -31.13 71.86 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.27 1.028 . . . . 0.0 113.092 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.7 tp -73.33 -35.72 66.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.279 1.432 . . . . 0.0 111.427 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -62.11 -45.2 94.54 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.082 -1.011 . . . . 0.0 110.88 169.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 tp -51.9 -46.35 64.55 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.441 1.496 . . . . 0.0 111.075 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.82 97.73 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.26 -44.2 99.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.687 0.795 . . . . 0.0 110.598 175.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.56 -49.88 76.07 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.265 0.626 . . . . 0.0 111.562 174.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.0 mmt85 -59.28 -34.81 72.72 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.036 -1.04 . . . . 0.0 112.414 175.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.52 66.96 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.132 0.878 . . . . 0.0 111.765 178.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -25.04 63.11 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.633 -0.667 . . . . 0.0 112.523 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.7 mt -81.93 -43.08 18.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.682 1.193 . . . . 0.0 112.381 175.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.5 p -84.24 -17.5 39.58 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -173.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.87 11.68 83.48 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 175.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.89 172.56 6.18 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.185 1.394 . . . . 0.0 110.147 171.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.13 159.64 14.76 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.455 2.103 . . . . 0.0 114.907 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.6 t -130.52 156.49 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 127.249 2.219 . . . . 0.0 107.53 171.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.99 169.78 35.3 Favored Glycine 0 N--CA 1.468 0.814 0 CA-C-N 120.323 1.42 . . . . 0.0 116.256 -171.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.43 128.85 66.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 125.178 1.391 . . . . 0.0 108.829 -173.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -107.64 59.95 0.62 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 129.178 2.991 . . . . 0.0 110.635 -168.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -53.84 141.13 28.19 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.3 1.04 . . . . 0.0 112.056 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.5 t -139.42 179.52 6.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.067 1.747 . . . . 0.0 111.769 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -66.64 -16.93 64.55 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -169.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.0 p -142.81 -5.02 0.92 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.76 -175.36 5.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.065 1.746 . . . . 0.0 110.599 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -146.07 164.82 30.92 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.697 1.599 . . . . 0.0 109.851 173.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.6 ttp-105 -148.45 154.97 40.6 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.104 1.762 . . . . 0.0 109.814 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.3 mt -114.82 141.18 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.576 1.151 . . . . 0.0 109.272 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 85.3 mtp -132.6 148.33 52.36 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 -174.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.8 158.28 37.43 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.777 2.431 . . . . 0.0 108.86 -168.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.51 153.09 79.01 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 122.104 1.869 . . . . 0.0 112.034 169.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.3 4.72 0.98 Allowed Glycine 0 CA--C 1.537 1.406 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -137.59 -23.71 1.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.6 t -158.21 139.09 9.39 Favored Pre-proline 0 N--CA 1.477 0.911 0 CA-C-N 119.44 1.018 . . . . 0.0 112.829 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.63 -12.78 3.56 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.299 3.333 . . . . 0.0 112.187 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.7 t -82.96 -22.38 33.77 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.056 1.342 . . . . 0.0 113.479 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.78 162.06 37.69 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.349 1.46 . . . . 0.0 111.721 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -52.4 123.34 10.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.472 1.509 . . . . 0.0 112.429 177.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -153.23 160.18 42.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.518 1.527 . . . . 0.0 111.86 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -145.28 146.24 31.57 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.693 1.197 . . . . 0.0 113.6 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.1 t -158.01 153.65 22.66 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.993 2.917 . . . . 0.0 107.724 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -69.52 134.64 28.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.236 1.958 . . . . 0.0 111.064 173.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -68.68 -26.28 65.22 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 123.328 1.537 . . . . 0.0 109.787 173.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -49.52 -14.31 0.11 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 127.968 2.507 . . . . 0.0 113.746 169.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -53.54 -32.74 51.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.929 1.692 . . . . 0.0 112.753 168.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -135.27 -13.04 2.1 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -176.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -121.58 58.24 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.209 1.403 . . . . 0.0 109.074 169.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.63 -23.43 1.01 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 -169.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -121.16 -4.2 9.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -171.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -129.08 -7.0 4.89 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.9 m -75.55 14.37 0.63 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.251 1.02 . . . . 0.0 113.603 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -155.63 -179.2 7.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.42 1.488 . . . . 0.0 110.988 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -51.93 128.02 22.93 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -168.86 -27.86 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.086 2.154 . . . . 0.0 111.439 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -69.23 -6.25 27.96 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.545 1.938 . . . . 0.0 114.796 -170.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.88 165.44 24.63 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.895 1.678 . . . . 0.0 113.442 -178.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.56 13.22 2.13 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.32 1.448 . . . . 0.0 112.841 171.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -155.09 3.48 0.2 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -168.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -120.19 162.87 18.62 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.292 -1.505 . . . . 0.0 113.482 -169.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 t -135.98 143.3 44.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.043 2.137 . . . . 0.0 108.735 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.9 143.88 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.116 1.366 . . . . 0.0 110.641 -169.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -140.17 134.51 31.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.352 1.461 . . . . 0.0 110.601 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mp -113.41 153.03 29.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.235 1.017 . . . . 0.0 113.15 -174.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -145.45 140.34 15.81 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 126.875 2.07 . . . . 0.0 108.745 -172.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -80.1 -5.95 41.37 Favored 'Cis proline' 0 CA--C 1.546 1.077 0 CA-C-N 120.841 1.336 . . . . 0.0 114.015 -3.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -107.35 155.96 19.43 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.84 1.256 . . . . 0.0 113.305 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.82 135.49 95.46 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -84.16 98.23 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 123.633 2.889 . . . . 0.0 108.797 168.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -148.0 156.38 42.59 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.028 -1.045 . . . . 0.0 112.259 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 41.75 0.28 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.99 1.716 . . . . 0.0 112.093 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 55.5 p -73.2 39.18 0.09 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.622 1.969 . . . . 0.0 115.281 -171.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.6 t30 57.33 19.5 5.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 127.022 2.129 . . . . 0.0 115.015 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -158.04 124.33 2.49 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.626 1.17 . . . . 0.0 110.429 -169.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.89 128.94 30.92 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 121.712 1.608 . . . . 0.0 111.212 172.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -78.34 -39.24 40.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.953 0.901 . . . . 0.0 111.311 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -99.98 136.23 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.896 1.678 . . . . 0.0 108.174 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.5 t -135.54 143.82 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 121.868 0.842 . . . . 0.0 111.108 -172.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -125.49 129.56 72.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 128.384 2.674 . . . . 0.0 107.968 -171.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.4 mt -94.08 162.62 13.8 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.097 0.951 . . . . 0.0 112.061 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.74 -9.41 6.36 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -175.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -121.12 9.74 10.57 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.746 1.619 . . . . 0.0 113.298 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.74 8.69 59.22 Favored Glycine 0 CA--C 1.535 1.304 0 N-CA-C 115.833 1.093 . . . . 0.0 115.833 173.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -74.93 137.8 41.92 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.9 1.35 . . . . 0.0 108.551 169.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.37 146.11 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.909 1.284 . . . . 0.0 109.479 -173.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.2 p -52.24 124.37 30.77 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 124.022 0.929 . . . . 0.0 111.539 170.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.64 112.87 3.59 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.742 2.295 . . . . 0.0 111.096 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.547 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.5 p90 -151.45 -179.27 7.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.35 1.86 . . . . 0.0 111.661 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -138.19 142.48 40.03 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.622 0.769 . . . . 0.0 112.156 169.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.07 102.77 8.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 129.235 3.014 . . . . 0.0 108.833 -170.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -96.62 147.9 23.4 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.544 1.138 . . . . 0.0 110.563 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.4 mtt -129.85 135.48 48.44 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.879 1.672 . . . . 0.0 109.271 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.66 152.71 48.3 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.158 1.383 . . . . 0.0 111.0 -176.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -61.09 127.28 30.78 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 121.814 -0.554 . . . . 0.0 109.806 175.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.97 -20.34 57.11 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -175.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.85 -32.65 0.68 Allowed Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.301 0.953 . . . . 0.0 114.582 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 6.9 m -68.38 -27.47 66.26 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.257 1.528 . . . . 0.0 111.255 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 70.55 35.82 68.06 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.806 0.717 . . . . 0.0 113.195 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -133.34 135.61 25.7 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 125.668 1.587 . . . . 0.0 110.439 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.41 152.33 79.0 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.012 2.475 . . . . 0.0 113.071 -176.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.34 -55.21 1.76 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.214 1.805 . . . . 0.0 111.565 -173.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -147.98 156.47 42.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 108.643 -169.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.6 m -147.46 138.56 23.65 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.059 -1.026 . . . . 0.0 110.243 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -109.61 146.21 35.13 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 126.814 2.046 . . . . 0.0 109.729 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 54.0 t -140.38 137.17 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.098 0.959 . . . . 0.0 112.038 -169.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.547 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 38.4 t -115.27 154.26 29.41 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.906 1.682 . . . . 0.0 111.641 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.4 m -130.35 9.52 5.18 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.944 1.298 . . . . 0.0 113.488 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.87 -9.61 10.45 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 114.943 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.9 p -156.53 160.07 39.15 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.637 1.219 . . . . 0.0 113.517 -173.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.0 t-105 -60.23 138.5 91.65 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.297 1.839 . . . . 0.0 115.501 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -97.9 177.22 7.93 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.128 1.081 . . . . 0.0 110.935 -11.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.26 160.26 32.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.855 169.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -100.81 166.04 11.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.065 1.346 . . . . 0.0 109.046 169.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -142.07 153.12 43.94 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.2 t -155.86 167.09 31.53 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.233 1.413 . . . . 0.0 112.254 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.89 135.85 48.25 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 109.971 169.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.98 70.5 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.724 2.41 . . . . 0.0 116.547 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 46.4 ptt85 44.03 31.6 0.54 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 128.798 2.839 . . . . 0.0 118.398 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -55.37 -24.04 27.58 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 174.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.6 p -97.43 -0.89 45.43 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.822 2.049 . . . . 0.0 113.759 176.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -138.54 62.18 28.17 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 126.33 1.852 . . . . 0.0 110.743 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.268 3.312 . . . . 0.0 113.369 178.968 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.8 -13.51 34.29 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.865 1.266 . . . . 0.0 114.084 172.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -131.71 -44.2 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.681 1.992 . . . . 0.0 111.181 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.56 79.58 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.448 1.499 . . . . 0.0 113.331 -177.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -65.55 -44.79 85.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.158 0.89 . . . . 0.0 111.207 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.3 m -62.01 -45.82 91.94 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.282 -0.886 . . . . 0.0 111.593 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -60.04 -38.55 83.1 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.328 -0.844 . . . . 0.0 112.253 175.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.81 -47.27 87.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.493 1.042 . . . . 0.0 112.032 174.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -63.54 -41.4 98.45 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.217 1.007 . . . . 0.0 111.379 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.98 -53.32 51.97 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 122.694 0.398 . . . . 0.0 111.782 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.0 m -55.76 -37.12 68.1 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.964 1.306 . . . . 0.0 111.425 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.14 -47.74 83.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.38 1.072 . . . . 0.0 113.89 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.81 98.13 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.389 -0.819 . . . . 0.0 112.254 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -65.08 -42.59 93.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.485 0.714 . . . . 0.0 110.959 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -60.08 -43.71 95.3 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.199 0.6 . . . . 0.0 112.408 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 34.9 m -59.82 -41.79 92.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 118.597 0.635 . . . . 0.0 111.156 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.39 -40.88 94.02 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.864 -1.148 . . . . 0.0 113.5 172.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.75 -33.51 75.82 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.171 -0.956 . . . . 0.0 113.041 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.49 -35.85 75.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.448 1.099 . . . . 0.0 111.742 173.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.36 -44.22 95.44 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.91 -1.119 . . . . 0.0 111.773 170.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.57 -45.15 62.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.188 1.395 . . . . 0.0 111.471 169.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.09 98.11 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.64 -45.79 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 118.898 0.772 . . . . 0.0 110.713 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.87 -23.95 66.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -103.03 -24.78 13.61 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.33 74.59 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.983 1.265 . . . . 0.0 113.801 176.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.7 t -69.4 -28.28 66.02 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 121.637 -0.664 . . . . 0.0 112.73 173.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.4 mt -85.2 -28.59 25.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.518 1.527 . . . . 0.0 113.219 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -86.44 -15.73 39.34 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -169.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.1 -9.3 33.3 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 124.507 1.051 . . . . 0.0 115.266 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -138.32 150.84 68.03 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 129.447 3.099 . . . . 0.0 105.406 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -40.41 154.97 0.05 OUTLIER 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.099 3.199 . . . . 0.0 115.507 169.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.9 t -104.01 161.84 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.871 1.268 . . . . 0.0 108.311 171.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -154.44 176.28 32.3 Favored Glycine 0 CA--C 1.522 0.521 0 CA-C-O 122.299 0.944 . . . . 0.0 114.991 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 63.2 mt -134.95 118.42 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 124.504 1.122 . . . . 0.0 108.002 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -76.8 152.97 35.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.347 1.459 . . . . 0.0 110.687 170.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -143.02 147.85 35.79 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.391 1.477 . . . . 0.0 113.03 -175.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.7 p -136.58 -176.36 4.32 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.569 1.948 . . . . 0.0 111.302 176.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.63 -25.29 62.55 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 178.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.6 p -143.2 -2.09 1.02 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -173.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.73 179.87 7.15 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.86 1.314 . . . . 0.0 112.988 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.458 ' CZ2' ' HA ' ' A' ' 74' ' ' ASN . 58.6 p-90 -149.15 162.78 39.3 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.303 2.241 . . . . 0.0 108.762 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 41.8 mtm-85 -143.96 132.04 21.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.402 1.081 . . . . 0.0 111.208 172.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.3 mm -69.76 130.82 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 171.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.8 mtm -134.11 147.79 50.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 122.077 0.942 . . . . 0.0 111.719 -176.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.7 164.83 33.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.912 1.285 . . . . 0.0 111.786 -169.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.03 -23.41 75.68 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.755 2.97 . . . . 0.0 114.527 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.86 -53.53 1.69 Allowed Glycine 0 CA--C 1.533 1.201 0 C-N-CA 126.929 2.204 . . . . 0.0 116.556 169.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -142.62 -23.05 0.66 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.294 1.437 . . . . 0.0 114.299 -172.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.3 t -133.32 124.12 18.06 Favored Pre-proline 0 N--CA 1.475 0.805 0 CA-C-N 119.021 0.828 . . . . 0.0 113.021 -174.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -86.55 -0.02 8.04 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.82 3.013 . . . . 0.0 111.929 169.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.7 m -111.74 -5.22 14.46 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.662 1.585 . . . . 0.0 114.262 -169.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -141.79 146.04 35.46 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.064 1.346 . . . . 0.0 110.839 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -51.27 -37.26 46.33 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.95 1.7 . . . . 0.0 115.047 -171.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 9.2 tpt85 -27.32 96.97 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 129.007 2.923 . . . . 0.0 115.241 -171.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.22 154.82 34.97 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.305 1.042 . . . . 0.0 112.124 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.6 m -143.82 151.0 51.97 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 125.886 1.674 . . . . 0.0 110.164 169.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.14 145.87 80.02 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.183 1.922 . . . . 0.0 110.21 169.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 63.6 tp -57.12 -71.84 0.09 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.337 1.055 . . . . 0.0 113.595 -169.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 43.83 1.79 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 130.612 3.565 . . . . 0.0 120.45 169.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -60.42 -21.76 62.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.499 1.919 . . . . 0.0 115.351 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -150.35 -38.94 0.14 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.951 1.701 . . . . 0.0 110.698 170.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.78 44.35 0.08 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.112 2.165 . . . . 0.0 113.12 169.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.31 20.44 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 -169.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -133.36 25.96 4.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.084 1.354 . . . . 0.0 112.033 170.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -120.19 -6.89 9.89 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.848 1.659 . . . . 0.0 111.679 173.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.9 m -71.16 -2.12 14.75 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.804 1.642 . . . . 0.0 113.123 169.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -139.5 168.99 18.58 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.571 1.548 . . . . 0.0 113.253 -175.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.458 ' HA ' ' CZ2' ' A' ' 47' ' ' TRP . 59.0 t30 -51.13 119.55 4.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 117.307 2.336 . . . . 0.0 117.307 -169.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -141.72 10.19 2.01 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.54 2.336 . . . . 0.0 111.459 169.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -79.52 -17.23 54.5 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.03 1.332 . . . . 0.0 113.529 -176.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.11 167.3 28.15 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -144.08 27.71 1.43 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.802 2.041 . . . . 0.0 110.247 169.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -141.45 -5.81 1.06 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.442 1.497 . . . . 0.0 114.636 -169.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.2 mt -115.3 163.4 15.74 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.865 1.317 . . . . 0.0 113.614 -170.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.2 t -134.38 134.79 42.1 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 128.672 2.789 . . . . 0.0 106.797 169.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.51 144.26 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.421 1.088 . . . . 0.0 110.884 -169.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -137.36 157.4 46.67 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.028 1.731 . . . . 0.0 109.585 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -153.71 168.56 25.84 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.546 -0.721 . . . . 0.0 112.902 172.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -157.65 155.08 26.43 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.525 1.93 . . . . 0.0 110.269 177.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -77.46 -10.75 31.7 Favored 'Cis proline' 0 CA--C 1.543 0.946 0 CA-C-N 120.898 1.357 . . . . 0.0 114.864 2.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -66.1 -178.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.303 1.441 . . . . 0.0 111.586 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.73 141.11 29.63 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -176.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.39 131.44 24.8 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.825 2.35 . . . . 0.0 110.407 175.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -160.38 -154.52 0.38 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.587 0.755 . . . . 0.0 111.523 -169.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -135.71 26.81 3.36 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.954 2.502 . . . . 0.0 110.148 169.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.2 m -60.37 156.87 14.9 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.124 2.17 . . . . 0.0 115.086 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -71.96 20.05 0.06 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 126.031 1.732 . . . . 0.0 114.84 175.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -150.36 161.29 31.11 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.379 1.872 . . . . 0.0 109.823 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.99 172.07 16.24 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 122.902 2.402 . . . . 0.0 112.964 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -108.64 -10.58 15.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.87 1.668 . . . . 0.0 111.958 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.56 139.33 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.238 1.415 . . . . 0.0 108.811 169.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 58.8 t -134.31 139.3 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 109.577 -175.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.92 119.16 48.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 126.635 1.974 . . . . 0.0 109.5 -169.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.64 152.27 40.55 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.373 1.469 . . . . 0.0 111.187 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.01 -28.64 58.15 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.895 1.278 . . . . 0.0 114.127 172.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.94 -11.31 59.59 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.628 1.571 . . . . 0.0 113.58 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.25 4.77 59.62 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 124.648 1.118 . . . . 0.0 114.887 -177.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -72.24 150.99 43.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.491 1.145 . . . . 0.0 108.408 169.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -128.82 137.55 56.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 124.774 1.23 . . . . 0.0 108.427 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.3 t -56.26 133.34 75.61 Favored Pre-proline 0 CA--C 1.544 0.75 0 CA-C-O 118.522 -0.752 . . . . 0.0 111.255 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -59.94 117.53 4.29 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.562 2.175 . . . . 0.0 112.82 174.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 5.6 p90 -155.13 175.6 13.63 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.448 1.499 . . . . 0.0 111.356 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 p -142.14 153.2 43.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.499 1.12 . . . . 0.0 110.508 169.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.12 134.67 33.18 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.884 2.073 . . . . 0.0 109.142 -169.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -125.71 143.17 51.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.461 1.504 . . . . 0.0 110.383 -175.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.4 mtt -122.07 128.98 51.98 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.556 1.542 . . . . 0.0 109.667 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.11 146.16 50.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.64 1.576 . . . . 0.0 111.573 -175.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -54.18 124.98 17.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.48 1.112 . . . . 0.0 109.927 171.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.55 -14.07 17.76 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 -174.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -103.9 -50.05 1.04 Allowed Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.917 1.246 . . . . 0.0 113.417 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.4 p -79.45 -27.77 41.62 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.442 1.121 . . . . 0.0 113.558 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.97 8.27 73.05 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.987 0.803 . . . . 0.0 113.01 -169.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.38 134.66 58.22 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 124.901 1.28 . . . . 0.0 110.836 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.57 144.13 65.38 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.787 2.325 . . . . 0.0 112.663 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.24 -40.38 4.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.922 0.889 . . . . 0.0 110.125 169.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.45 154.81 38.36 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.327 1.051 . . . . 0.0 111.383 -169.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.9 m -145.75 145.78 30.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.966 1.307 . . . . 0.0 109.986 177.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.5 mp -120.17 144.55 47.63 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.122 2.569 . . . . 0.0 109.365 -179.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 15.9 t -142.23 138.07 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.253 1.021 . . . . 0.0 111.581 -170.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 10.6 t -116.7 152.89 33.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.432 1.093 . . . . 0.0 112.234 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 39.6 m -130.5 5.86 4.77 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.312 1.445 . . . . 0.0 113.19 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.85 -15.25 5.43 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 115.915 1.126 . . . . 0.0 115.915 172.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.2 t -151.64 159.04 44.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.76 1.78 . . . . 0.0 113.798 -172.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 -57.5 135.28 82.02 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 126.465 1.906 . . . . 0.0 115.524 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -96.28 175.98 10.34 Favored 'Cis proline' 0 CA--C 1.547 1.146 0 CA-C-N 120.139 1.086 . . . . 0.0 110.603 -11.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.43 161.75 22.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.245 1.022 . . . . 0.0 112.085 169.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -90.12 154.79 19.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.208 1.403 . . . . 0.0 107.788 169.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -139.44 152.54 47.12 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.3 t -155.18 151.35 28.09 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.692 1.197 . . . . 0.0 112.031 -169.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.98 131.92 45.85 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 169.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.57 66.08 0.12 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.628 1.971 . . . . 0.0 115.267 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 52.05 13.77 0.29 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 118.58 2.808 . . . . 0.0 118.58 178.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -57.51 -32.17 66.76 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -169.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 68.3 p -79.77 -18.21 51.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 68.4 ttt-85 -66.73 -47.03 56.54 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-O 116.54 -1.695 . . . . 0.0 115.263 -171.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo . . . . . 0 C--O 1.249 1.071 0 C-N-CA 122.729 2.286 . . . . 0.0 113.223 -178.428 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 . . . . . 0 N--CA 1.473 0.684 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -66.57 -42.07 87.62 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.24 -40.05 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.716 -0.659 . . . . 0.0 109.987 175.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.3 95.95 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.311 0.959 . . . . 0.0 112.659 173.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.19 -42.43 96.65 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.049 -1.032 . . . . 0.0 111.575 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.0 m -61.16 -50.37 73.42 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.745 0.818 . . . . 0.0 111.711 173.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -57.46 -40.4 78.44 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.914 1.686 . . . . 0.0 112.408 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.98 72.01 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.989 0.813 . . . . 0.0 111.376 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -61.73 -41.69 97.99 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.129 0.972 . . . . 0.0 111.876 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.47 -50.01 71.38 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.767 1.227 . . . . 0.0 112.538 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 61.8 m -65.28 -30.26 71.11 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.237 -0.915 . . . . 0.0 112.113 174.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.9 87.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.679 1.127 . . . . 0.0 113.496 172.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.85 -43.76 98.2 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.35 -0.844 . . . . 0.0 111.372 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -64.76 -39.2 93.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.525 0.73 . . . . 0.0 112.664 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -61.31 -42.5 98.77 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 111.774 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.8 m -59.32 -43.86 92.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.424 0.556 . . . . 0.0 110.727 175.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -41.87 96.5 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.981 -1.075 . . . . 0.0 113.474 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.86 -32.71 74.32 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.997 0.919 . . . . 0.0 113.128 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.9 tp -73.04 -33.87 65.96 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.06 1.344 . . . . 0.0 111.683 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.41 -44.23 95.26 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.948 -1.095 . . . . 0.0 110.877 169.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.7 -45.33 66.82 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.34 1.456 . . . . 0.0 111.288 169.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.61 98.03 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.92 -47.29 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.088 0.858 . . . . 0.0 110.684 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -60.34 -35.44 75.65 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.708 0.803 . . . . 0.0 112.796 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -76.29 -36.63 58.26 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.389 0.676 . . . . 0.0 112.626 174.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.92 -36.06 82.72 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.833 1.197 . . . . 0.0 112.96 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -73.32 -27.32 61.46 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.9 -25.34 23.3 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.9 m -89.28 -22.07 22.88 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -169.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.75 5.85 89.27 Favored Glycine 0 CA--C 1.542 1.734 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -143.44 150.81 52.67 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 127.653 2.381 . . . . 0.0 107.302 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -46.24 163.25 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.761 2.974 . . . . 0.0 114.593 169.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -123.37 160.72 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.616 1.566 . . . . 0.0 108.459 176.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.63 173.75 34.37 Favored Glycine 0 CA--C 1.521 0.458 0 N-CA-C 116.111 1.204 . . . . 0.0 116.111 -177.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.2 mt -132.63 123.66 49.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.832 1.253 . . . . 0.0 108.998 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -83.48 145.76 28.76 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.597 1.959 . . . . 0.0 110.758 170.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -141.55 145.2 34.82 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.311 1.445 . . . . 0.0 111.801 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.2 p -146.83 176.12 10.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.996 1.318 . . . . 0.0 112.056 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -61.09 -10.11 5.66 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.445 1.098 . . . . 0.0 113.86 170.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.9 m -130.7 -15.8 3.44 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.92 168.73 24.82 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 123.178 1.466 . . . . 0.0 114.079 -178.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -135.74 144.33 45.8 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.904 2.882 . . . . 0.0 105.478 169.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -160.01 129.62 5.26 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.674 0.79 . . . . 0.0 111.508 -172.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mt -92.57 139.36 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.2 mtp -136.66 145.27 44.59 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.038 0.935 . . . . 0.0 112.189 -169.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 m -138.46 160.79 62.22 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 126.574 1.95 . . . . 0.0 112.137 -169.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -81.17 12.04 2.82 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.048 3.165 . . . . 0.0 115.406 -171.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -39.66 -40.17 1.44 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 127.005 2.24 . . . . 0.0 118.687 -169.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -69.1 -44.5 72.35 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.219 1.51 . . . . 0.0 112.895 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -167.92 129.87 1.24 Allowed Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 123.935 0.894 . . . . 0.0 112.83 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.2 -24.6 6.55 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.029 2.486 . . . . 0.0 111.725 169.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.4 m -75.18 -24.86 57.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.542 1.537 . . . . 0.0 113.517 -175.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.48 21.06 4.73 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.339 1.455 . . . . 0.0 112.674 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . 0.27 0.0 OUTLIER 54.08 -13.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 131.567 3.947 . . . . 0.0 120.288 173.475 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -38.74 110.01 0.12 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 128.062 2.545 . . . . 0.0 114.198 -170.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.87 153.92 40.64 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.172 1.389 . . . . 0.0 113.92 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 t -136.49 140.59 32.84 Favored Pre-proline 0 N--CA 1.469 0.495 0 C-N-CA 126.891 2.076 . . . . 0.0 108.194 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -63.53 151.71 83.69 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 CA-C-N 121.156 1.449 . . . . 0.0 109.716 169.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 15.8 tp -65.65 12.7 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -176.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -61.38 -13.53 20.64 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.022 -1.674 . . . . 0.0 114.077 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.58 -15.09 24.3 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.358 1.063 . . . . 0.0 113.424 169.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -141.58 -44.59 0.36 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.091 1.356 . . . . 0.0 112.389 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.56 47.69 1.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.212 1.805 . . . . 0.0 111.697 173.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.7 -35.15 1.71 Allowed 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 -169.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -129.08 15.25 6.26 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.212 1.405 . . . . 0.0 112.578 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -143.46 6.05 1.45 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -174.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 82.6 p -58.18 -20.13 38.69 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -157.95 168.89 25.87 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.49 1.516 . . . . 0.0 113.48 -169.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.81 -41.1 0.07 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.84 3.256 . . . . 0.0 118.008 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -73.19 70.42 1.12 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.309 1.844 . . . . 0.0 111.331 176.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -129.15 -28.71 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -168.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.58 176.65 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.413 1.006 . . . . 0.0 113.642 -176.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -125.93 -25.04 3.67 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.579 1.952 . . . . 0.0 113.477 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -139.17 14.53 2.62 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.383 1.073 . . . . 0.0 113.599 -169.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -124.16 156.19 37.14 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -168.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.3 m -133.01 134.3 44.25 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.565 2.746 . . . . 0.0 107.806 169.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -113.37 141.51 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.366 1.066 . . . . 0.0 110.55 -169.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -140.1 85.56 2.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.554 1.542 . . . . 0.0 110.426 -170.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.3 157.22 37.43 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.928 -1.107 . . . . 0.0 112.486 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.82 145.34 27.45 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.852 1.661 . . . . 0.0 109.365 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.56 -14.29 24.46 Favored 'Cis proline' 0 CA--C 1.543 0.975 0 CA-C-N 120.076 1.063 . . . . 0.0 113.825 -4.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -60.62 119.95 9.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.142 1.377 . . . . 0.0 112.328 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.43 145.83 85.89 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.262 1.025 . . . . 0.0 113.505 -177.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.92 63.96 8.73 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 124.311 3.341 . . . . 0.0 112.386 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -147.67 159.13 44.12 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.158 1.383 . . . . 0.0 111.735 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -74.34 89.63 2.1 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.655 1.217 . . . . 0.0 113.594 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 p -61.02 -3.41 0.79 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 128.043 2.537 . . . . 0.0 116.224 171.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 2.6 p30 54.31 6.9 0.12 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.476 2.31 . . . . 0.0 115.82 -169.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -140.84 165.37 30.04 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 128.66 2.784 . . . . 0.0 108.23 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.2 155.09 65.26 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-N 120.094 1.069 . . . . 0.0 112.155 169.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -102.37 -44.55 5.36 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.595 1.158 . . . . 0.0 110.72 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.79 135.72 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 89.7 t -136.04 139.12 46.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.684 1.194 . . . . 0.0 109.745 -177.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.5 119.43 50.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 127.578 2.351 . . . . 0.0 108.206 -170.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -83.23 159.55 21.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.768 0.794 . . . . 0.0 111.355 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.25 -26.12 50.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.074 1.349 . . . . 0.0 114.449 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -76.01 -16.67 59.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.805 1.642 . . . . 0.0 113.595 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.05 7.14 64.41 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.331 0.967 . . . . 0.0 114.498 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -84.66 143.23 29.35 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 169.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.4 mm -125.75 149.77 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.14 1.376 . . . . 0.0 109.966 -168.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.8 t -56.34 134.07 76.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 O-C-N 121.655 -0.653 . . . . 0.0 110.925 169.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -75.65 117.35 4.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.51 2.14 . . . . 0.0 111.216 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.498 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 10.1 p90 -149.05 179.09 8.14 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 127.055 2.142 . . . . 0.0 111.021 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -138.59 155.54 48.25 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 111.246 169.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.4 tp -136.97 103.72 5.24 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.875 2.07 . . . . 0.0 108.985 -169.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -95.19 147.09 23.83 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.364 0.665 . . . . 0.0 110.446 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 59.0 mtt -126.7 125.66 42.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.741 1.616 . . . . 0.0 110.392 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.79 140.1 52.25 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.205 1.402 . . . . 0.0 111.55 -176.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -64.52 119.38 10.34 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.142 0.977 . . . . 0.0 110.565 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.43 -22.03 52.93 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 178.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -84.38 -19.57 60.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.724 1.154 . . . . 0.0 115.269 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.2 p -135.18 -24.56 1.42 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.276 1.538 . . . . 0.0 114.445 -170.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 84.6 -1.78 88.56 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.975 1.274 . . . . 0.0 114.105 -172.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -79.45 138.97 55.18 Favored Pre-proline 0 CA--C 1.545 0.773 0 CA-C-N 118.682 1.241 . . . . 0.0 112.22 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.14 146.42 57.81 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.779 2.319 . . . . 0.0 111.642 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.94 -42.06 2.85 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.976 0.91 . . . . 0.0 111.265 174.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -148.86 159.73 43.9 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.589 1.156 . . . . 0.0 111.245 -168.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.8 m -148.2 139.99 23.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.728 1.211 . . . . 0.0 109.521 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.9 mp -109.55 144.82 37.32 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.524 1.93 . . . . 0.0 109.374 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 35.1 t -138.48 136.14 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.654 1.182 . . . . 0.0 111.366 -169.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.498 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 20.1 t -115.98 154.87 29.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.108 1.363 . . . . 0.0 111.843 178.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 m -131.98 9.95 4.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.187 1.395 . . . . 0.0 113.267 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 115.89 -6.75 19.81 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.85 1.214 . . . . 0.0 115.217 176.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 73.4 m -149.05 150.66 33.15 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.649 1.224 . . . . 0.0 113.33 -169.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -58.45 137.0 85.66 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 124.909 1.284 . . . . 0.0 114.41 173.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.17 174.66 11.54 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 CA-C-N 120.147 1.088 . . . . 0.0 111.032 -11.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.28 166.01 15.13 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.076 0.941 . . . . 0.0 110.937 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -110.54 165.05 12.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.999 1.32 . . . . 0.0 109.132 171.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -141.98 155.66 45.45 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.4 t -151.87 151.08 30.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.678 1.591 . . . . 0.0 111.005 -173.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.73 133.04 47.82 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 67.91 0.07 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.871 2.068 . . . . 0.0 115.431 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 0.0 OUTLIER 50.05 16.47 0.24 Allowed 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.28 -34.32 70.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.5 p -88.26 -12.31 44.02 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 174.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -61.8 134.91 94.2 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.011 0.925 . . . . 0.0 112.523 -169.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo . . . . . 0 C--O 1.25 1.088 0 C-N-CA 123.691 2.927 . . . . 0.0 113.264 168.878 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.914 0.388 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.46 -11.59 16.94 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.801 2.04 . . . . 0.0 115.156 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.07 -44.44 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 125.652 1.581 . . . . 0.0 110.088 173.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.23 -38.42 86.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -56.23 -50.02 72.48 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.275 0.943 . . . . 0.0 112.65 172.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.6 m -64.77 -49.59 70.16 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.564 0.746 . . . . 0.0 111.131 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -72.16 -26.82 62.24 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -172.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.06 -53.32 58.62 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.44 1.018 . . . . 0.0 110.767 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -66.47 -36.56 83.07 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.286 0.634 . . . . 0.0 112.502 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -59.69 -48.6 81.02 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.17 169.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.3 m -58.93 -41.51 87.52 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.538 0.735 . . . . 0.0 111.179 176.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.62 -40.4 88.76 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 175.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.7 96.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.339 -0.851 . . . . 0.0 111.533 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.34 -44.56 96.2 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.829 0.852 . . . . 0.0 111.704 174.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -59.81 -44.34 94.06 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 172.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 48.3 m -61.16 -44.04 97.94 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.819 0.736 . . . . 0.0 110.8 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.76 95.36 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.053 -1.029 . . . . 0.0 113.165 172.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.18 -33.94 77.2 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.016 0.926 . . . . 0.0 113.143 175.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -71.7 -33.16 68.55 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.654 1.182 . . . . 0.0 112.143 171.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -63.93 -43.74 94.96 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.888 -1.132 . . . . 0.0 111.14 169.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.33 -45.54 69.11 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.77 1.628 . . . . 0.0 111.255 169.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.32 -47.04 86.01 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.478 0.711 . . . . 0.0 112.394 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -59.11 -41.23 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.787 -1.196 . . . . 0.0 111.401 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.04 -42.32 97.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.439 0.696 . . . . 0.0 112.768 172.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -63.44 -35.08 79.24 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.603 1.161 . . . . 0.0 112.943 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.0 95.07 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -174.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.3 t -76.85 -23.08 52.71 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 98.6 mt -89.61 -36.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.64 1.176 . . . . 0.0 113.172 -176.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.0 p -84.34 -16.58 42.41 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.47 -0.01 76.95 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -142.59 149.25 49.92 Favored Pre-proline 0 N--CA 1.471 0.582 0 C-N-CA 126.438 1.895 . . . . 0.0 108.576 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -47.66 144.81 10.25 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.214 1.942 . . . . 0.0 111.077 168.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.5 m -109.39 175.12 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.773 0.829 . . . . 0.0 111.15 -178.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.38 165.69 30.95 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 115.408 0.923 . . . . 0.0 115.408 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.47 116.07 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 124.915 1.286 . . . . 0.0 107.955 177.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 34.5 t-80 -80.52 147.14 30.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 126.775 2.03 . . . . 0.0 111.243 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.9 142.18 30.65 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.706 1.602 . . . . 0.0 111.622 -179.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 24.1 p -132.94 177.0 7.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.782 1.633 . . . . 0.0 111.553 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -57.99 -14.72 7.0 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 170.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.9 m -137.06 -10.72 1.74 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -169.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.34 174.4 15.49 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.932 1.242 . . . . 0.0 112.602 179.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 12.4 p90 -142.07 156.06 45.39 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.409 1.484 . . . . 0.0 110.018 169.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -150.91 151.93 32.89 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.167 1.387 . . . . 0.0 110.64 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 6.0 mt -109.15 141.84 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.977 0.808 . . . . 0.0 109.606 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.1 mtp -134.74 149.98 50.51 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.421 1.088 . . . . 0.0 111.407 -175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.4 m -142.48 169.19 11.38 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 127.073 2.149 . . . . 0.0 111.372 -169.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -55.94 -36.37 95.65 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.476 2.784 . . . . 0.0 114.862 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 66.14 -42.38 0.16 Allowed Glycine 0 CA--C 1.541 1.659 0 C-N-CA 127.147 2.308 . . . . 0.0 117.037 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -143.84 -31.25 0.47 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -172.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.4 p -134.0 57.06 22.06 Favored Pre-proline 0 N--CA 1.485 1.289 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -169.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.24 -20.51 70.29 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 122.871 2.381 . . . . 0.0 114.547 -177.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -64.11 -8.94 13.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.322 1.449 . . . . 0.0 114.453 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -135.98 -128.53 0.15 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.262 1.825 . . . . 0.0 110.595 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -139.53 118.42 12.48 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.685 1.594 . . . . 0.0 109.894 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -152.53 159.5 43.29 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.36 1.464 . . . . 0.0 110.654 176.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 40.8 m95 -136.4 130.32 32.55 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.695 1.198 . . . . 0.0 112.239 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.2 t -142.38 138.0 16.08 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 126.748 2.019 . . . . 0.0 108.051 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -50.77 131.6 34.3 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.223 2.615 . . . . 0.0 112.81 170.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 29.4 tp -68.28 108.14 3.08 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.033 0.933 . . . . 0.0 111.02 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -138.61 -13.15 1.3 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -54.48 -29.04 48.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.604 1.562 . . . . 0.0 114.382 -172.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -142.28 27.06 1.77 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.178 1.791 . . . . 0.0 111.769 169.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -143.42 39.04 1.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.692 2.397 . . . . 0.0 109.541 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.13 -24.03 2.51 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 117.033 2.235 . . . . 0.0 117.033 -168.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -132.34 20.51 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.635 1.574 . . . . 0.0 112.031 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -132.39 4.3 3.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.384 1.474 . . . . 0.0 113.29 -170.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -34.86 41.15 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.157 1.783 . . . . 0.0 114.705 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -130.86 151.08 51.68 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.533 1.933 . . . . 0.0 111.277 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.09 158.64 43.88 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.078 1.351 . . . . 0.0 112.493 -169.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -158.18 58.68 0.46 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.89 2.076 . . . . 0.0 109.006 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 9.7 m0 -59.91 -24.34 64.23 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 117.02 2.23 . . . . 0.0 117.02 -169.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 166.06 20.16 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.731 1.15 . . . . 0.0 113.791 -177.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -137.4 15.14 2.98 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.45 1.1 . . . . 0.0 112.638 169.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.51 7.6 0.25 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.879 1.271 . . . . 0.0 113.817 -171.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.76 169.44 13.85 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.479 1.511 . . . . 0.0 112.03 -172.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -138.61 140.92 39.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.565 1.946 . . . . 0.0 109.024 169.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.8 143.97 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 125.339 1.456 . . . . 0.0 110.258 -173.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -137.52 152.82 49.89 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.614 1.966 . . . . 0.0 109.728 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.5 tt -151.16 146.23 25.97 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.868 0.867 . . . . 0.0 111.98 -170.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -149.14 156.71 40.18 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 125.408 1.483 . . . . 0.0 110.517 169.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -77.2 -16.13 25.61 Favored 'Cis proline' 0 CA--C 1.541 0.843 0 CA-C-N 120.355 1.163 . . . . 0.0 114.128 -0.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -70.08 151.57 45.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.57 1.148 . . . . 0.0 113.418 -175.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -63.45 119.3 52.26 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.896 1.678 . . . . 0.0 112.582 178.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -80.29 64.85 8.92 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.137 3.225 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -145.92 157.3 43.9 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.262 1.425 . . . . 0.0 111.587 -174.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -66.7 75.46 0.11 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.826 1.65 . . . . 0.0 113.872 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.9 t -75.85 159.15 31.28 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.653 1.981 . . . . 0.0 113.146 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.16 -8.59 55.55 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.317 1.447 . . . . 0.0 113.085 169.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -134.41 163.97 47.33 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 125.825 1.65 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.34 145.16 37.97 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 121.549 1.5 . . . . 0.0 110.466 168.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -73.91 -53.24 10.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.227 1.011 . . . . 0.0 111.017 173.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.0 t -81.92 140.31 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.667 1.187 . . . . 0.0 109.496 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 53.7 t -130.91 142.9 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.959 0.903 . . . . 0.0 111.07 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.99 127.42 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 127.784 2.433 . . . . 0.0 108.736 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.3 mt -89.12 156.9 18.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.394 0.616 . . . . 0.0 111.307 170.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.2 -21.77 60.0 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -71.16 -20.27 62.32 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.976 1.71 . . . . 0.0 113.575 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.62 3.3 62.75 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.897 1.237 . . . . 0.0 114.775 -177.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.02 147.09 28.37 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 118.455 1.127 . . . . 0.0 108.663 169.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.1 mm -131.42 155.89 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 124.935 1.294 . . . . 0.0 110.241 -168.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.7 p -55.67 129.6 70.74 Favored Pre-proline 0 N--CA 1.471 0.587 0 O-C-N 121.273 -0.892 . . . . 0.0 110.224 169.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -71.89 119.88 6.49 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.186 1.924 . . . . 0.0 111.456 175.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.454 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 13.1 p90 -149.84 174.74 12.32 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.229 1.811 . . . . 0.0 111.337 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 94.7 p -137.53 151.62 48.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.683 0.754 . . . . 0.0 111.118 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -139.76 128.32 22.99 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.281 1.832 . . . . 0.0 108.48 -169.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -123.24 150.96 42.78 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.611 1.565 . . . . 0.0 110.275 -173.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.5 mtt -129.67 142.13 50.78 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.873 1.269 . . . . 0.0 109.614 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.5 143.65 41.8 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.02 1.328 . . . . 0.0 111.046 -177.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.19 122.09 15.28 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.683 0.674 . . . . 0.0 110.133 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.07 -23.32 65.38 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -176.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -97.5 -48.67 1.95 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.766 1.174 . . . . 0.0 113.037 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.3 m -66.87 -31.28 71.78 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 117.951 0.875 . . . . 0.0 112.046 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.68 30.63 61.59 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 123.998 0.809 . . . . 0.0 113.665 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -133.36 149.35 72.17 Favored Pre-proline 0 N--CA 1.474 0.729 0 C-N-CA 125.873 1.669 . . . . 0.0 111.218 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.17 152.03 83.57 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.173 2.582 . . . . 0.0 112.2 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.76 -45.87 1.17 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 126.082 1.753 . . . . 0.0 112.36 -169.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.4 tp -151.66 154.74 36.97 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.33 1.452 . . . . 0.0 109.275 -173.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -146.38 144.79 29.98 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 123.856 0.862 . . . . 0.0 109.628 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.5 mt -126.0 136.38 52.92 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.561 2.345 . . . . 0.0 108.168 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.99 126.93 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.399 1.08 . . . . 0.0 110.708 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.454 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 43.4 t -93.82 -44.31 8.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -172.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 20.4 m 54.18 -5.54 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 -173.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.65 -1.5 3.97 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.342 1.448 . . . . 0.0 116.001 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 6.2 t -156.67 156.18 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.858 1.829 . . . . 0.0 114.88 -172.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.5 t-105 -61.18 137.53 94.27 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 125.812 1.645 . . . . 0.0 114.937 175.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -94.69 174.58 13.72 Favored 'Cis proline' 0 CA--C 1.546 1.09 0 CA-C-N 120.048 1.053 . . . . 0.0 110.487 -11.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.29 145.72 55.42 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.625 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -96.9 127.56 42.99 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.092 1.757 . . . . 0.0 110.555 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -96.17 143.66 27.08 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.526 1.53 . . . . 0.0 112.252 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.1 t -147.35 151.96 37.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.582 1.553 . . . . 0.0 111.334 170.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.57 132.62 44.92 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.48 64.34 0.11 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.939 2.096 . . . . 0.0 115.732 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 0.0 OUTLIER 48.58 15.44 0.09 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 128.655 2.782 . . . . 0.0 117.891 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.25 -39.49 79.29 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.4 m -86.53 -15.05 41.21 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.51 1.124 . . . . 0.0 112.836 178.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 48.9 ttt-85 -66.98 138.02 94.91 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 120.991 -1.068 . . . . 0.0 112.237 -171.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 123.629 2.886 . . . . 0.0 113.137 168.648 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.65 -36.15 78.21 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.311 -0.868 . . . . 0.0 112.6 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.3 t -73.55 -36.14 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.543 1.137 . . . . 0.0 110.584 173.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.86 70.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.605 1.162 . . . . 0.0 112.701 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -57.83 -56.53 20.73 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.418 1.008 . . . . 0.0 112.418 169.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.4 m -58.9 -46.24 88.36 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.604 0.761 . . . . 0.0 111.297 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -65.96 -36.11 82.44 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 117.516 -1.231 . . . . 0.0 113.249 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.28 70.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.889 1.677 . . . . 0.0 110.978 171.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -61.89 -40.8 96.68 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.734 1.214 . . . . 0.0 111.973 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.7 tp10 -64.37 -50.19 68.65 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.265 1.426 . . . . 0.0 112.465 173.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 92.2 m -58.5 -37.17 75.02 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.173 1.389 . . . . 0.0 111.032 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.41 -44.93 70.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.666 1.187 . . . . 0.0 114.142 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.367 -0.833 . . . . 0.0 111.571 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -67.39 -39.42 85.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.736 0.815 . . . . 0.0 112.315 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.33 -39.85 92.06 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.094 0.861 . . . . 0.0 112.068 171.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.6 m -58.83 -42.09 88.44 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.57 -0.707 . . . . 0.0 110.827 174.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.21 -36.92 85.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.793 -1.192 . . . . 0.0 113.973 171.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.71 -32.91 73.88 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 120.774 -1.204 . . . . 0.0 113.321 174.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.9 tp -70.07 -34.73 73.56 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.192 -0.942 . . . . 0.0 111.637 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -62.6 -45.22 93.87 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.162 -0.961 . . . . 0.0 111.579 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.1 tp -53.98 -48.22 70.58 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.522 1.129 . . . . 0.0 111.542 170.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.14 -42.17 80.48 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 176.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.11 -45.19 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.195 -0.941 . . . . 0.0 111.123 172.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.42 -6.83 7.98 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.578 1.551 . . . . 0.0 113.884 174.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 57.4 mmt-85 -109.54 -31.36 7.53 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.932 1.293 . . . . 0.0 112.139 172.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.33 -33.49 74.79 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.037 1.289 . . . . 0.0 113.055 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 t -69.5 -15.34 63.23 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 173.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 67.7 mt -112.71 -30.9 6.92 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.554 1.542 . . . . 0.0 114.15 -173.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.6 m -77.59 -21.36 52.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -169.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.3 -5.19 60.53 Favored Glycine 0 CA--C 1.543 1.787 0 N-CA-C 115.284 0.874 . . . . 0.0 115.284 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -136.48 150.32 70.13 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 128.428 2.691 . . . . 0.0 106.566 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -45.9 151.49 1.38 Allowed 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.819 2.346 . . . . 0.0 112.815 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.4 t -113.49 160.25 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.224 1.41 . . . . 0.0 108.788 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.21 172.67 29.25 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 115.39 0.916 . . . . 0.0 115.39 -176.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.2 mt -134.77 113.99 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.902 1.281 . . . . 0.0 109.132 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -75.18 149.03 39.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.91 1.284 . . . . 0.0 110.008 169.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -136.8 139.35 41.71 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.326 1.45 . . . . 0.0 112.638 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.1 p -115.62 -175.49 2.73 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.248 1.819 . . . . 0.0 109.819 169.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.86 -10.37 37.52 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 173.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 94.5 p -146.15 -11.63 0.49 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -172.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -142.45 169.9 16.71 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.208 1.367 . . . . 0.0 112.47 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 35.6 p-90 -123.25 161.76 23.95 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.82 1.648 . . . . 0.0 110.323 171.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -146.71 121.7 10.04 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.176 1.39 . . . . 0.0 110.586 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.2 mm -80.94 138.39 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 95.0 mtp -137.69 144.36 41.75 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.153 0.981 . . . . 0.0 111.388 -171.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.7 m -140.61 166.31 23.95 Favored Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 127.478 2.311 . . . . 0.0 111.176 -169.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.62 167.61 9.69 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.0 2.467 . . . . 0.0 114.162 173.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.86 164.69 31.86 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.434 1.969 . . . . 0.0 110.256 169.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 85.1 tttt 59.38 -52.5 0.06 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 127.909 2.484 . . . . 0.0 115.469 -169.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 t -152.88 142.48 14.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 125.817 1.647 . . . . 0.0 112.208 -172.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -80.17 -16.65 10.92 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.435 2.757 . . . . 0.0 112.532 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 m -82.14 -5.89 58.78 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -169.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -146.95 150.33 34.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.891 1.276 . . . . 0.0 111.664 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -55.35 115.59 2.36 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.774 1.63 . . . . 0.0 112.088 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.3 tpt85 -153.29 154.47 34.67 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.519 1.528 . . . . 0.0 110.1 176.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -137.94 148.62 45.44 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.952 0.901 . . . . 0.0 112.823 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.4 t -150.79 144.44 17.26 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 129.633 3.173 . . . . 0.0 106.791 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -62.92 154.43 66.76 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 CA-C-N 121.795 1.677 . . . . 0.0 111.307 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.6 21.8 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -61.33 -10.22 6.73 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.02 -2.3 . . . . 0.0 114.023 177.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -65.92 -20.72 66.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.327 1.051 . . . . 0.0 113.061 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.87 -12.48 0.56 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -127.28 55.8 1.57 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.731 2.412 . . . . 0.0 108.091 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -39.88 -38.72 0.72 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 117.327 2.343 . . . . 0.0 117.327 -169.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -130.76 18.6 5.14 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.547 1.539 . . . . 0.0 112.033 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -136.85 1.51 2.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.786 1.635 . . . . 0.0 113.024 -170.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.1 p -60.85 -16.28 39.62 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.758 1.623 . . . . 0.0 115.08 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.94 138.92 39.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.357 1.463 . . . . 0.0 111.054 171.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -162.21 -179.99 7.47 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -142.97 166.2 25.29 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.769 2.428 . . . . 0.0 110.574 173.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -136.31 16.32 3.2 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -147.58 171.5 15.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.327 1.051 . . . . 0.0 113.168 -170.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -137.76 14.14 2.92 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.518 1.527 . . . . 0.0 111.715 169.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.47 11.55 0.79 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.979 1.712 . . . . 0.0 114.833 -172.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.4 mt -109.79 160.39 16.38 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.707 1.139 . . . . 0.0 112.879 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 64.5 m -134.79 124.41 25.11 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 127.229 2.212 . . . . 0.0 107.604 169.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -96.42 142.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.675 1.19 . . . . 0.0 109.983 -175.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -139.4 155.31 47.71 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.234 1.813 . . . . 0.0 109.74 175.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.0 mp -139.21 162.24 35.47 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.173 -0.954 . . . . 0.0 112.718 -177.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.17 145.87 14.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 126.144 1.778 . . . . 0.0 110.399 169.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -72.0 -9.58 15.84 Favored 'Cis proline' 0 CA--C 1.544 1.02 0 CA-C-N 120.575 1.241 . . . . 0.0 113.284 -8.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -64.22 173.6 1.92 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.816 1.647 . . . . 0.0 113.141 171.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -127.38 137.71 31.25 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.214 1.405 . . . . 0.0 111.191 -169.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -78.71 59.51 7.28 Favored 'Trans proline' 0 CA--C 1.549 1.254 0 C-N-CA 124.814 3.676 . . . . 0.0 112.097 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -151.43 148.04 27.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.936 1.294 . . . . 0.0 112.429 -173.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -77.85 82.61 4.22 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.352 1.072 . . . . 0.0 113.535 -177.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 64.1 p -68.02 8.6 0.39 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.147 2.179 . . . . 0.0 114.723 169.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.7 m120 60.77 21.39 11.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.664 1.986 . . . . 0.0 114.106 -175.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -145.98 168.26 12.17 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 126.891 2.076 . . . . 0.0 109.672 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.53 149.62 56.06 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 120.931 1.088 . . . . 0.0 111.388 169.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -77.46 -60.26 2.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.19 0.996 . . . . 0.0 109.883 170.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 41.0 t -84.42 142.13 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.278 1.431 . . . . 0.0 109.504 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 75.6 t -131.0 144.27 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 110.863 175.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -126.84 130.88 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.123 2.569 . . . . 0.0 109.342 -169.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.6 mt -94.13 157.05 16.25 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.428 0.632 . . . . 0.0 111.222 169.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.8 -24.36 56.9 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -71.49 -18.54 62.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.979 1.712 . . . . 0.0 113.468 176.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.72 6.0 62.57 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.575 1.083 . . . . 0.0 114.394 -175.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -84.35 142.4 30.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.416 1.108 . . . . 0.0 108.709 169.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -129.27 152.73 37.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 125.882 1.673 . . . . 0.0 110.12 -168.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.4 p -55.49 118.66 19.97 Favored Pre-proline 0 N--CA 1.471 0.6 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.259 169.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -68.42 126.46 14.24 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 121.946 1.764 . . . . 0.0 111.102 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -157.13 173.64 16.68 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.755 1.222 . . . . 0.0 112.951 -175.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -133.62 149.8 51.6 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.778 0.831 . . . . 0.0 111.053 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.1 tp -139.56 120.5 14.52 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.946 2.098 . . . . 0.0 108.364 -173.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -110.28 148.71 31.37 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.953 1.701 . . . . 0.0 110.455 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.6 mtt -126.38 134.29 51.08 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.294 1.438 . . . . 0.0 108.579 176.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -130.15 153.36 48.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.23 1.412 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.85 129.21 39.0 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.675 0.67 . . . . 0.0 110.022 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.56 -16.33 62.46 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -93.18 -53.86 1.82 Allowed Glycine 0 CA--C 1.533 1.189 0 C-N-CA 124.139 0.875 . . . . 0.0 113.101 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 63.1 p -79.03 -26.66 43.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.09 0.945 . . . . 0.0 113.283 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 76.8 3.73 80.52 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.885 1.231 . . . . 0.0 113.563 -169.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.65 131.36 61.19 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.767 1.284 . . . . 0.0 111.759 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.3 144.58 30.08 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.662 2.908 . . . . 0.0 114.273 172.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.71 -43.85 2.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.477 1.911 . . . . 0.0 112.071 -175.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -155.02 156.01 35.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.874 1.67 . . . . 0.0 108.876 -172.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.5 m -141.82 148.24 38.54 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.352 1.061 . . . . 0.0 109.426 171.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 37.0 mt -122.46 140.36 52.82 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.557 2.343 . . . . 0.0 107.64 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.2 t -143.56 130.1 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.71 0.804 . . . . 0.0 111.786 -169.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 36.0 t -117.22 115.12 24.69 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.206 1.403 . . . . 0.0 110.94 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -74.45 -10.01 59.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.447 1.099 . . . . 0.0 113.952 174.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 135.73 -0.65 3.42 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.949 1.262 . . . . 0.0 115.495 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 72.2 m -147.35 151.89 37.29 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.147 1.474 . . . . 0.0 113.301 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -60.34 135.58 91.4 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 125.469 1.508 . . . . 0.0 114.854 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -94.04 167.5 19.98 Favored 'Cis proline' 0 CA--C 1.545 1.073 0 CA-C-N 120.346 1.159 . . . . 0.0 110.398 -11.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . 0.258 0.1 OUTLIER -84.92 158.39 20.58 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.19 -0.944 . . . . 0.0 112.474 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -75.59 174.36 9.82 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.181 2.192 . . . . 0.0 113.78 -169.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -135.5 137.5 42.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.594 1.957 . . . . 0.0 110.34 169.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.8 t -152.93 162.91 40.72 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.897 1.279 . . . . 0.0 111.577 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -88.43 134.01 33.96 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.56 58.87 0.67 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.18 1.792 . . . . 0.0 115.086 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 62.54 11.06 4.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 127.209 2.204 . . . . 0.0 116.909 176.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.98 -29.47 63.28 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -169.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 81.3 p -91.92 -9.62 42.51 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.52 14.59 Favored Pre-proline 0 N--CA 1.478 0.95 0 CA-C-O 116.202 -1.856 . . . . 0.0 115.835 -174.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 C--O 1.25 1.113 0 C-N-CA 123.971 3.114 . . . . 0.0 115.18 176.776 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.61 -39.76 80.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.865 0.757 . . . . 0.0 112.629 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.46 -41.68 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.754 0.822 . . . . 0.0 110.318 176.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -49.31 78.05 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.471 0.709 . . . . 0.0 111.903 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.24 -35.35 78.66 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.306 0.957 . . . . 0.0 112.666 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.4 m -61.95 -53.22 58.73 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.016 0.826 . . . . 0.0 111.219 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -61.17 -33.33 73.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.206 1.002 . . . . 0.0 112.885 177.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.2 90.18 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.379 1.072 . . . . 0.0 113.01 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.3 mtt-85 -63.93 -42.27 97.41 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.966 0.906 . . . . 0.0 110.841 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.8 -46.23 86.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.986 0.914 . . . . 0.0 112.26 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.1 m -59.69 -42.45 93.02 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.923 1.289 . . . . 0.0 111.252 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.71 77.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.346 1.058 . . . . 0.0 113.681 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.15 97.04 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.314 -0.866 . . . . 0.0 111.537 173.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 52.4 tpt85 -64.02 -39.33 93.85 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.324 1.05 . . . . 0.0 112.427 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.82 -43.32 93.48 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.47 1.108 . . . . 0.0 113.022 170.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.1 m -60.11 -43.17 95.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.228 0.611 . . . . 0.0 110.416 176.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.97 94.97 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.069 -1.019 . . . . 0.0 113.49 171.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.7 -36.38 83.46 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.181 -0.949 . . . . 0.0 113.246 176.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.6 tp -71.45 -33.64 69.53 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.418 1.087 . . . . 0.0 111.603 174.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.02 -44.46 96.67 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.055 -1.028 . . . . 0.0 111.334 169.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -45.26 62.78 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.467 1.507 . . . . 0.0 111.74 169.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.7 -45.18 87.7 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 176.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 59.8 mt -61.65 -45.21 99.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.526 1.131 . . . . 0.0 110.831 177.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.02 -27.94 69.23 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.649 1.18 . . . . 0.0 113.271 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -92.78 -30.27 15.57 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.08 -29.92 67.69 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.2 t -77.72 -14.64 59.55 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 173.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.3 mt -106.14 -37.14 6.69 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.302 1.441 . . . . 0.0 113.651 -172.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.4 m -85.6 -7.91 58.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -173.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.17 -1.87 88.48 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 115.384 0.914 . . . . 0.0 115.384 170.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -142.15 148.36 47.87 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 127.167 2.187 . . . . 0.0 107.843 171.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -44.63 152.6 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.721 2.947 . . . . 0.0 113.942 168.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.26 161.84 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.673 1.589 . . . . 0.0 108.105 175.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.14 173.07 34.08 Favored Glycine 0 N--CA 1.465 0.615 0 CA-C-N 120.118 1.326 . . . . 0.0 115.473 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.9 mt -136.62 123.48 31.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 C-N-CA 124.583 1.153 . . . . 0.0 109.18 -177.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -88.92 151.73 22.15 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.882 1.673 . . . . 0.0 110.605 171.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -141.14 144.73 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.179 1.392 . . . . 0.0 112.676 -173.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.4 p -128.03 179.69 5.44 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.772 1.629 . . . . 0.0 110.589 170.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.7 1.45 12.29 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 121.313 -0.867 . . . . 0.0 113.254 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -138.27 -21.21 1.06 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -173.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.33 175.82 12.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.061 1.345 . . . . 0.0 112.144 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 26.7 p90 -139.0 147.8 42.62 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 126.006 1.722 . . . . 0.0 109.069 175.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -141.65 113.59 7.94 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.233 1.413 . . . . 0.0 111.284 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.0 mt -78.57 137.53 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 24.1 mtm -134.07 155.27 50.32 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.977 1.311 . . . . 0.0 110.885 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.4 p -147.18 161.76 35.3 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.654 1.182 . . . . 0.0 110.956 -168.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -59.72 144.03 99.52 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.627 2.218 . . . . 0.0 112.567 169.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -131.44 -13.67 1.85 Allowed Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.574 1.083 . . . . 0.0 115.24 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -158.21 153.45 25.69 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.298 2.239 . . . . 0.0 108.803 174.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . 0.261 15.3 t 33.4 68.06 1.05 Allowed Pre-proline 0 N--CA 1.483 1.196 0 C-N-CA 126.457 1.903 . . . . 0.0 115.999 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -52.41 -24.68 22.32 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.09 2.527 . . . . 0.0 113.949 170.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -57.12 -14.86 4.38 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.879 2.072 . . . . 0.0 115.141 171.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.28 -108.91 0.26 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.374 1.469 . . . . 0.0 111.263 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -154.05 119.59 5.19 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.236 1.414 . . . . 0.0 110.731 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.1 tpt85 -153.52 153.23 32.02 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.505 1.522 . . . . 0.0 110.384 173.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -136.42 147.06 47.07 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.453 1.101 . . . . 0.0 111.486 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -149.04 144.15 17.77 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 126.944 2.098 . . . . 0.0 108.363 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.66 131.75 42.8 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 122.745 2.296 . . . . 0.0 112.683 171.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.9 tp -67.54 99.06 0.72 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.853 1.261 . . . . 0.0 111.098 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -139.97 -7.08 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -171.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.84 -27.59 52.26 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.651 1.18 . . . . 0.0 114.142 -173.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -139.46 31.0 2.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.975 1.71 . . . . 0.0 110.897 169.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -148.61 45.15 1.03 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.849 2.46 . . . . 0.0 109.082 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.2 123.06 8.69 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.956 1.303 . . . . 0.0 112.937 -169.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.1 t70 57.66 11.21 1.22 Allowed 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 -177.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -123.32 26.98 7.7 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.408 -1.432 . . . . 0.0 113.784 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.9 p -62.66 -40.01 95.71 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.093 0.957 . . . . 0.0 112.434 169.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.16 139.96 30.62 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.333 1.053 . . . . 0.0 110.707 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -138.96 157.76 45.43 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -169.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -156.76 53.36 0.52 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.776 2.03 . . . . 0.0 110.037 -169.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 15.8 m0 -60.78 18.3 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.619 2.768 . . . . 0.0 118.358 -169.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -144.91 179.37 7.38 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.375 -1.453 . . . . 0.0 113.671 -173.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -137.23 16.82 2.98 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.51 1.524 . . . . 0.0 112.852 175.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.67 -1.26 0.7 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.8 mt -119.64 163.53 17.24 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.967 1.365 . . . . 0.0 114.436 -169.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.0 t -136.29 129.31 31.27 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 128.237 2.615 . . . . 0.0 106.949 168.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.83 137.59 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.648 1.179 . . . . 0.0 109.61 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -133.24 132.01 40.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.916 1.286 . . . . 0.0 109.58 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -116.85 145.23 43.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.691 1.196 . . . . 0.0 111.846 -169.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -145.45 151.41 47.14 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.476 1.91 . . . . 0.0 110.495 -172.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -75.92 -15.33 24.31 Favored 'Cis proline' 0 CA--C 1.543 0.953 0 CA-C-N 120.244 1.123 . . . . 0.0 112.337 -10.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -64.63 133.82 53.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.652 . . . . 0.0 111.868 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.14 147.51 90.62 Favored Pre-proline 0 CA--C 1.547 0.833 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 176.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -71.42 142.28 40.49 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.723 2.282 . . . . 0.0 109.588 169.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -154.99 -159.21 0.92 Allowed 'General case' 0 CA--C 1.549 0.936 0 O-C-N 121.507 -0.745 . . . . 0.0 112.221 -171.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -143.07 41.79 1.53 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.485 2.714 . . . . 0.0 108.106 168.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 34.9 t -65.9 154.49 39.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.764 2.026 . . . . 0.0 114.214 -169.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -69.98 -9.37 54.95 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 113.316 169.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -126.06 161.13 53.48 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 125.046 1.339 . . . . 0.0 111.548 176.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.51 158.62 43.88 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.376 2.051 . . . . 0.0 112.062 169.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -87.94 -28.93 21.19 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.692 0.797 . . . . 0.0 111.061 169.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -113.21 134.74 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.994 1.317 . . . . 0.0 109.826 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 87.6 t -133.0 140.79 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.408 1.083 . . . . 0.0 110.775 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -118.7 120.23 63.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 127.304 2.241 . . . . 0.0 108.652 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.5 mt -89.21 158.65 17.8 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.129 0.966 . . . . 0.0 111.742 176.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.17 -23.0 53.78 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -106.77 7.39 30.31 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.726 1.211 . . . . 0.0 113.932 -172.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 100.01 12.4 39.96 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 115.559 0.984 . . . . 0.0 115.559 172.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -98.78 140.34 33.11 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.614 1.207 . . . . 0.0 109.848 169.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 2.9 mp -133.76 143.83 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.757 1.623 . . . . 0.0 108.068 -169.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 p -50.16 123.15 15.81 Favored Pre-proline 0 N--CA 1.475 0.779 0 C-N-CA 124.328 1.051 . . . . 0.0 111.613 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.76 123.5 13.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.675 2.25 . . . . 0.0 112.929 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.432 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.2 p90 -152.21 174.24 14.0 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.388 1.475 . . . . 0.0 111.36 176.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 65.7 m -145.94 146.57 31.1 Favored 'General case' 0 C--N 1.33 -0.251 0 O-C-N 121.307 -0.871 . . . . 0.0 111.373 172.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.2 tp -129.2 124.47 34.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 127.641 2.377 . . . . 0.0 108.392 -169.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -120.19 144.86 47.48 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.492 1.117 . . . . 0.0 110.118 -177.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.1 mtt -123.06 129.99 52.2 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 109.629 -178.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.11 138.68 52.62 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.187 1.395 . . . . 0.0 111.088 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -57.92 123.62 16.43 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.989 1.316 . . . . 0.0 111.535 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -17.81 54.92 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -116.82 -45.03 0.56 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.09 1.329 . . . . 0.0 113.943 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.0 m -73.3 -25.65 60.74 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.679 1.239 . . . . 0.0 112.338 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.9 33.35 57.68 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.022 0.82 . . . . 0.0 113.984 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -136.71 139.59 29.55 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.287 1.435 . . . . 0.0 111.375 -169.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -52.14 146.57 30.19 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.942 3.095 . . . . 0.0 114.626 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.07 -8.71 1.02 Allowed 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.0 tp -163.07 152.71 15.42 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.42 1.488 . . . . 0.0 110.308 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 1.1 m -139.71 146.24 39.35 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.642 1.577 . . . . 0.0 108.781 169.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.59 139.17 53.82 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.745 2.418 . . . . 0.0 108.829 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.9 t -137.01 128.44 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.46 0.704 . . . . 0.0 112.328 -170.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.432 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 52.7 t -105.64 109.41 21.36 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.305 1.442 . . . . 0.0 109.977 172.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 63.7 p -74.04 -17.35 60.98 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 143.58 -8.12 2.03 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.068 1.318 . . . . 0.0 115.034 -177.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.5 p -153.99 161.05 42.25 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.214 1.507 . . . . 0.0 113.899 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -61.73 137.89 95.19 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 125.95 1.7 . . . . 0.0 115.533 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -94.64 177.67 10.75 Favored 'Cis proline' 0 CA--C 1.547 1.157 0 CA-C-N 120.032 1.047 . . . . 0.0 110.513 -11.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.32 153.88 41.48 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.073 -1.017 . . . . 0.0 111.757 171.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -88.26 161.39 17.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.372 1.469 . . . . 0.0 109.505 169.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -138.26 140.63 39.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.621 1.568 . . . . 0.0 111.247 -169.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 2.4 t -150.36 157.46 43.07 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.81 2.044 . . . . 0.0 109.703 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -82.57 -12.31 57.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -169.56 65.94 0.05 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.152 1.381 . . . . 0.0 114.044 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.07 12.31 2.37 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 116.904 2.187 . . . . 0.0 116.904 171.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.23 -28.9 69.49 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 120.715 1.598 . . . . 0.0 113.822 -177.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 36.0 p -89.18 3.37 52.15 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.059 1.744 . . . . 0.0 113.743 175.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -115.85 85.15 14.05 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 125.99 1.716 . . . . 0.0 111.399 -170.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--O 1.25 1.091 0 C-N-CA 123.07 2.514 . . . . 0.0 112.093 172.099 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.49 -33.8 75.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 39.0 t -73.58 -44.08 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.843 0.857 . . . . 0.0 110.199 175.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.55 95.75 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 118.772 0.714 . . . . 0.0 111.904 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -56.58 -48.85 76.48 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.072 1.349 . . . . 0.0 112.509 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 176.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -59.09 -40.98 86.96 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.262 -0.875 . . . . 0.0 112.66 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.67 83.69 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.955 1.252 . . . . 0.0 111.886 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -68.32 -39.38 82.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.454 1.102 . . . . 0.0 111.457 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.57 -44.57 90.28 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.121 0.568 . . . . 0.0 112.219 171.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.1 m -60.08 -38.63 83.47 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.866 1.267 . . . . 0.0 111.589 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -44.25 81.0 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 173.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.5 98.64 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 121.349 -0.844 . . . . 0.0 112.034 174.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -60.84 -47.72 85.07 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.834 1.254 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -58.59 -43.39 89.49 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 174.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -57.84 -43.01 85.58 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.06 0.845 . . . . 0.0 111.021 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.32 89.33 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.882 -1.136 . . . . 0.0 113.722 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.84 -31.2 71.66 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.972 -1.08 . . . . 0.0 113.46 176.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 tp -70.23 -35.98 74.22 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.376 1.07 . . . . 0.0 111.498 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.43 -44.73 95.72 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.12 -0.987 . . . . 0.0 111.653 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 tp -53.67 -48.1 69.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.614 1.166 . . . . 0.0 111.393 169.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.84 -38.48 85.63 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.9 mt -64.95 -46.21 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.953 0.901 . . . . 0.0 110.935 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.81 -40.89 89.89 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.8 -0.563 . . . . 0.0 112.115 175.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -67.31 -41.61 85.06 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.464 -0.772 . . . . 0.0 112.398 173.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.07 -38.11 87.57 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.948 1.249 . . . . 0.0 112.605 176.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.38 -24.19 50.63 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.959 -0.463 . . . . 0.0 112.17 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -32.92 17.71 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.08 0.952 . . . . 0.0 113.122 177.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.9 m -79.99 -21.45 43.62 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -169.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.54 8.5 87.61 Favored Glycine 0 CA--C 1.541 1.709 0 CA-C-N 118.82 0.736 . . . . 0.0 114.616 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -144.99 149.06 41.03 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 127.584 2.354 . . . . 0.0 107.595 171.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.06 160.3 0.29 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.485 2.79 . . . . 0.0 113.719 168.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.1 t -127.56 162.24 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 126.629 1.971 . . . . 0.0 109.099 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.58 178.64 28.78 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 115.216 0.846 . . . . 0.0 115.216 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -133.59 116.63 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.793 1.237 . . . . 0.0 109.358 -172.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -85.36 68.46 10.48 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.877 2.071 . . . . 0.0 110.851 -176.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -61.65 153.1 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.716 0.806 . . . . 0.0 113.075 169.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 p -139.37 -177.05 4.75 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.308 2.243 . . . . 0.0 109.77 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -57.76 -21.98 44.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 173.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m -138.39 -4.08 1.68 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -171.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.42 176.17 10.24 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 122.361 1.077 . . . . 0.0 113.409 -176.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -154.55 161.58 41.56 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.821 2.448 . . . . 0.0 108.49 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.7 148.33 1.12 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.741 2.016 . . . . 0.0 109.879 169.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.6 mm -73.29 147.23 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.058 0.543 . . . . 0.0 109.756 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 61.6 mtp -128.65 134.58 48.57 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.094 1.358 . . . . 0.0 108.804 169.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -134.71 160.04 69.91 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 125.39 1.476 . . . . 0.0 109.878 -168.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -63.39 -24.78 71.13 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.25 1.967 . . . . 0.0 115.135 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.91 -52.76 0.05 OUTLIER Glycine 0 CA--C 1.54 1.608 0 C-N-CA 129.219 3.295 . . . . 0.0 116.738 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -144.03 -18.11 0.58 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 128.164 2.586 . . . . 0.0 112.689 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 p -131.1 69.59 82.41 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 125.099 1.36 . . . . 0.0 113.161 -169.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -71.0 27.77 0.21 Allowed 'Trans proline' 0 CA--C 1.55 1.305 0 C-N-CA 124.974 3.783 . . . . 0.0 113.763 173.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 m -71.14 -35.19 71.6 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.073 1.749 . . . . 0.0 113.932 -170.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -173.22 -44.55 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.631 1.572 . . . . 0.0 112.98 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -148.53 -66.76 0.23 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.174 0.99 . . . . 0.0 112.67 -172.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -12.41 87.73 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 129.226 3.01 . . . . 0.0 115.547 -172.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -73.69 161.03 30.71 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 36.0 t -139.72 134.48 16.12 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 128.022 2.529 . . . . 0.0 107.205 170.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -65.04 133.58 36.25 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.049 1.833 . . . . 0.0 110.167 174.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -76.46 82.02 3.17 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.802 0.811 . . . . 0.0 111.075 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -132.21 17.82 4.5 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.325 1.85 . . . . 0.0 112.584 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -58.66 -24.04 60.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.746 1.218 . . . . 0.0 114.088 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -145.43 -33.31 0.36 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.731 1.613 . . . . 0.0 112.36 173.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.9 28.36 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.989 1.715 . . . . 0.0 113.922 169.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.6 -25.55 10.96 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.617 1.967 . . . . 0.0 116.101 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -132.05 18.41 4.55 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.063 1.745 . . . . 0.0 112.603 175.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -136.86 -2.01 2.16 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.505 1.522 . . . . 0.0 113.617 -173.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 79.7 p -65.12 -14.32 60.26 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -176.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -135.11 162.25 33.02 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.752 1.221 . . . . 0.0 113.997 -172.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.289 48.2 t-20 40.75 -114.57 0.21 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.945 2.098 . . . . 0.0 113.434 -168.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.5 t70 56.34 8.07 0.39 Allowed 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 125.906 1.683 . . . . 0.0 114.825 -169.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 49.8 m0 -115.42 -33.76 5.16 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.621 -1.3 . . . . 0.0 112.935 -170.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 169.07 23.32 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -142.03 25.5 1.93 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.987 1.715 . . . . 0.0 111.097 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -143.33 -1.62 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -169.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 52.0 mt -117.06 165.24 13.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -169.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -133.94 131.43 39.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 128.794 2.838 . . . . 0.0 107.341 169.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -103.37 142.47 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 124.817 1.247 . . . . 0.0 109.468 -174.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -139.24 149.38 44.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.581 1.552 . . . . 0.0 109.547 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 83.9 mt -132.42 160.46 36.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.014 0.925 . . . . 0.0 112.727 -171.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.55 142.83 13.11 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.823 1.649 . . . . 0.0 110.029 169.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -73.19 -8.28 18.15 Favored 'Cis proline' 0 CA--C 1.547 1.155 0 CA-C-N 120.419 1.185 . . . . 0.0 113.516 -9.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -64.48 173.68 2.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.133 1.773 . . . . 0.0 112.891 174.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -118.16 134.39 23.36 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.228 1.411 . . . . 0.0 112.224 -175.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -78.59 74.25 5.53 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 124.123 3.215 . . . . 0.0 111.256 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -136.42 144.87 44.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.573 1.149 . . . . 0.0 111.567 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -76.34 56.17 1.05 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.351 1.461 . . . . 0.0 111.627 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.7 p -65.51 -6.46 10.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 128.479 2.712 . . . . 0.0 117.083 -169.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.68 26.08 15.84 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 113.97 -170.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -142.66 165.59 25.78 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 125.546 1.538 . . . . 0.0 109.775 169.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.96 142.74 69.91 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 121.437 1.425 . . . . 0.0 113.226 171.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.31 -13.22 18.91 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.851 2.061 . . . . 0.0 112.297 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -133.36 141.16 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.154 1.782 . . . . 0.0 108.019 173.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.4 t -133.18 144.26 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.487 1.115 . . . . 0.0 110.815 -174.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -130.2 121.16 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 127.948 2.499 . . . . 0.0 108.934 -169.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.5 157.81 31.8 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.988 1.315 . . . . 0.0 111.236 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.79 -7.81 5.69 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -178.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -115.56 8.31 15.09 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.724 1.61 . . . . 0.0 112.989 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.35 8.96 67.66 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 115.321 0.888 . . . . 0.0 115.321 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -78.84 144.4 35.05 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 169.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.3 mm -130.79 126.8 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.289 1.036 . . . . 0.0 108.763 -169.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 79.1 m -57.71 113.16 5.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -178.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -50.74 133.55 39.27 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 124.174 3.25 . . . . 0.0 115.839 -170.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -165.23 176.69 8.19 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.761 2.025 . . . . 0.0 111.4 179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.0 t -141.15 146.15 36.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.633 1.173 . . . . 0.0 109.216 168.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tp -131.11 120.78 23.86 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 126.72 2.008 . . . . 0.0 108.704 -169.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.5 tt -112.11 148.34 34.17 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.485 1.514 . . . . 0.0 110.047 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 70.5 mtm -132.12 137.73 47.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.349 1.06 . . . . 0.0 109.372 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.42 155.89 49.82 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.94 1.696 . . . . 0.0 110.184 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -63.3 132.75 52.61 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 119.009 0.822 . . . . 0.0 110.327 173.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.21 -33.07 67.14 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -175.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.36 -47.44 3.79 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 119.016 0.825 . . . . 0.0 114.314 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.5 p -80.35 -28.05 38.17 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.81 7.57 70.33 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.887 0.756 . . . . 0.0 112.939 -169.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -71.15 128.22 90.65 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.969 1.307 . . . . 0.0 110.494 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.51 149.49 87.66 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.544 2.163 . . . . 0.0 112.008 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.25 -47.95 1.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.808 1.643 . . . . 0.0 111.884 -172.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.3 tt -153.31 149.0 27.43 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.391 1.476 . . . . 0.0 108.799 -169.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.0 m -139.88 143.62 36.79 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.964 0.906 . . . . 0.0 110.085 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.3 mt -122.78 148.0 45.87 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 127.047 2.139 . . . . 0.0 108.675 -178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.7 t -142.84 135.86 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.284 0.634 . . . . 0.0 111.788 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 30.7 t -113.83 151.57 31.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.925 1.29 . . . . 0.0 111.581 176.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -128.64 -0.44 5.49 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.758 1.623 . . . . 0.0 113.787 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.24 -13.1 5.21 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.819 1.199 . . . . 0.0 115.381 176.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.6 t -153.04 156.07 38.06 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.478 1.639 . . . . 0.0 113.48 -174.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -55.98 137.99 72.46 Favored Pre-proline 0 CA--C 1.552 1.047 0 C-N-CA 126.738 2.015 . . . . 0.0 115.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -96.17 178.39 8.69 Favored 'Cis proline' 0 CA--C 1.55 1.283 0 CA-C-N 120.099 1.071 . . . . 0.0 110.793 -11.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.03 159.61 30.43 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.041 -1.037 . . . . 0.0 112.159 169.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -90.8 168.43 11.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.881 1.672 . . . . 0.0 109.902 169.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -143.79 141.88 30.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.254 1.821 . . . . 0.0 111.847 -169.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.2 t -153.72 162.8 40.93 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.275 1.43 . . . . 0.0 111.116 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -84.75 137.12 33.39 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.593 -0.692 . . . . 0.0 109.155 170.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 23.87 65.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 127.556 2.342 . . . . 0.0 116.317 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 58.3 mtm180 57.25 9.67 0.74 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 118.043 2.608 . . . . 0.0 118.043 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -56.78 -20.73 23.94 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.467 1.485 . . . . 0.0 114.948 -175.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.83 12.29 6.23 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.596 1.558 . . . . 0.0 113.052 175.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -74.74 135.27 74.78 Favored Pre-proline 0 N--CA 1.482 1.128 0 O-C-N 120.442 -1.412 . . . . 0.0 110.032 176.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 C--O 1.249 1.069 0 C-N-CA 122.935 2.423 . . . . 0.0 113.318 171.188 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 N--CA 1.473 0.694 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -67.8 -45.51 74.59 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.889 0.875 . . . . 0.0 112.602 -176.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.8 t -63.59 -46.03 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.564 0.745 . . . . 0.0 110.44 173.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.06 78.99 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.481 0.582 . . . . 0.0 112.329 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.75 -42.85 97.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.279 0.945 . . . . 0.0 111.992 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -60.62 -46.95 88.35 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.601 1.091 . . . . 0.0 111.402 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -61.31 -36.07 79.12 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.303 -0.856 . . . . 0.0 112.474 172.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.5 88.19 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.68 1.127 . . . . 0.0 112.763 175.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -61.74 -41.28 97.44 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.497 0.719 . . . . 0.0 111.271 178.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -64.73 -52.74 55.5 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.018 0.527 . . . . 0.0 111.945 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.5 m -52.82 -41.02 63.81 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.382 1.473 . . . . 0.0 111.559 177.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.72 -48.22 69.9 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.711 1.205 . . . . 0.0 113.593 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.93 -42.46 94.01 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.663 0.665 . . . . 0.0 112.34 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -68.52 -38.01 80.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.165 0.586 . . . . 0.0 111.226 175.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -58.71 -43.85 90.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.055 -0.974 . . . . 0.0 112.724 172.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -44.31 83.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.642 1.564 . . . . 0.0 111.988 173.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.05 -39.7 94.65 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.349 0.977 . . . . 0.0 113.099 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.96 78.57 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.089 0.956 . . . . 0.0 113.25 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.54 -36.9 71.14 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 0.0 111.359 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.52 -44.27 96.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.963 -1.085 . . . . 0.0 111.533 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.0 tp -53.07 -45.92 68.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.198 1.399 . . . . 0.0 111.419 169.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.23 -42.04 98.95 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 176.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 75.2 mt -61.89 -47.14 94.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.877 0.871 . . . . 0.0 110.528 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.82 -34.08 75.3 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.867 0.867 . . . . 0.0 113.019 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.0 ttt85 -79.05 -35.05 43.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.667 0.787 . . . . 0.0 113.023 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.34 -25.1 67.71 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -176.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.0 t -77.55 -14.29 59.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 171.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 76.8 mt -108.01 -30.88 8.21 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.009 1.723 . . . . 0.0 113.09 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.8 p -69.23 -29.79 67.81 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.548 1.939 . . . . 0.0 115.088 -176.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.99 83.04 Favored Glycine 0 CA--C 1.542 1.729 0 C-N-CA 124.895 1.236 . . . . 0.0 114.875 -176.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -145.42 145.76 27.45 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 127.247 2.219 . . . . 0.0 107.985 171.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -40.73 139.01 1.38 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.275 2.65 . . . . 0.0 112.955 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.5 t -91.13 162.7 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.47 1.508 . . . . 0.0 108.786 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -146.82 169.41 27.95 Favored Glycine 0 CA--C 1.521 0.447 0 O-C-N 120.914 -1.116 . . . . 0.0 114.637 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.7 mt -136.06 116.6 18.08 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 125.001 1.32 . . . . 0.0 107.5 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -78.6 153.61 30.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.958 1.303 . . . . 0.0 110.688 170.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -141.2 142.54 33.98 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.254 1.822 . . . . 0.0 111.303 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 t -144.34 175.53 10.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.997 1.719 . . . . 0.0 111.26 -176.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -49.07 -29.77 5.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.501 1.921 . . . . 0.0 115.816 -169.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 82.4 p -140.97 14.62 2.27 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.023 1.329 . . . . 0.0 113.586 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.08 171.66 17.52 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.759 1.266 . . . . 0.0 114.355 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -138.28 160.26 39.93 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 127.771 2.428 . . . . 0.0 107.868 169.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -154.19 125.5 7.42 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.797 1.239 . . . . 0.0 110.885 -176.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 16.9 mm -72.82 142.42 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.207 -178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -137.15 151.2 48.54 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.801 1.241 . . . . 0.0 112.25 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -145.45 167.94 13.18 Favored Pre-proline 0 N--CA 1.478 0.948 0 C-N-CA 126.248 1.819 . . . . 0.0 111.277 -169.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -60.79 -23.82 77.46 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.184 2.589 . . . . 0.0 115.866 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.12 -145.32 49.05 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 121.631 -0.668 . . . . 0.0 111.858 -169.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -73.21 1.15 9.88 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 116.635 2.087 . . . . 0.0 116.635 -174.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.6 p -125.47 38.73 0.42 Allowed Pre-proline 0 N--CA 1.485 1.309 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -61.56 -15.07 39.1 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.098 2.532 . . . . 0.0 115.282 -169.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -60.88 -15.21 28.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.455 1.502 . . . . 0.0 114.45 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -145.03 166.91 23.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.901 1.68 . . . . 0.0 111.9 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -63.62 117.91 7.48 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.052 0.941 . . . . 0.0 111.897 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -154.05 160.11 41.85 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.651 1.58 . . . . 0.0 110.528 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -139.79 142.92 36.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.665 1.186 . . . . 0.0 112.52 174.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -150.83 145.14 17.92 Favored Pre-proline 0 N--CA 1.47 0.561 0 C-N-CA 126.099 1.759 . . . . 0.0 109.126 169.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.22 147.18 36.51 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.511 2.141 . . . . 0.0 111.794 169.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.68 12.72 0.12 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -178.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -61.62 -18.41 59.33 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.175 -1.578 . . . . 0.0 113.698 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.44 -18.85 65.64 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -145.83 -16.07 0.47 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -120.43 13.58 11.84 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.04 1.336 . . . . 0.0 112.264 169.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 53.41 -168.64 0.06 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.636 2.375 . . . . 0.0 114.443 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -55.47 -16.6 3.92 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.291 -1.505 . . . . 0.0 113.967 173.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.35 3.15 9.57 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.754 2.021 . . . . 0.0 113.858 174.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -62.54 16.74 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.793 2.037 . . . . 0.0 115.367 174.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -146.73 175.18 10.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.005 1.722 . . . . 0.0 114.305 -169.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -51.48 134.2 29.18 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -173.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -150.87 16.67 0.77 Allowed 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 127.116 2.166 . . . . 0.0 111.44 169.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -88.83 -9.36 51.99 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 -169.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.7 171.79 13.58 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -136.53 9.52 3.15 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.374 1.87 . . . . 0.0 112.301 175.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -157.15 15.8 0.27 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -169.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 68.7 mt -110.66 152.96 25.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.251 -1.531 . . . . 0.0 114.102 -177.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.7 t -131.23 134.94 46.93 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.769 2.827 . . . . 0.0 106.779 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -112.12 139.07 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 125.311 1.445 . . . . 0.0 110.323 -169.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -139.14 123.31 18.0 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.163 1.385 . . . . 0.0 110.747 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.8 mp -106.25 157.22 17.75 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.33 1.062 . . . . 0.0 112.739 -177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.92 126.66 7.27 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.775 2.03 . . . . 0.0 108.846 -174.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -75.99 -9.28 27.14 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.333 1.155 . . . . 0.0 113.605 -8.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -70.29 152.15 44.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.248 1.419 . . . . 0.0 113.972 -170.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.54 120.94 80.51 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.249 1.42 . . . . 0.0 113.453 179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -79.68 63.12 8.7 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.3 3.333 . . . . 0.0 111.098 170.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -157.86 154.19 27.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.0 1.72 . . . . 0.0 110.515 -174.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -56.26 66.18 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.837 2.855 . . . . 0.0 116.925 -173.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.9 t -62.9 158.33 19.35 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.851 2.06 . . . . 0.0 113.479 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -71.07 -7.01 43.52 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.168 1.387 . . . . 0.0 113.46 171.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -136.44 161.76 60.25 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.748 1.619 . . . . 0.0 111.449 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.71 142.86 44.76 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 121.628 1.552 . . . . 0.0 110.17 168.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -72.44 -22.55 61.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.471 1.109 . . . . 0.0 112.31 174.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.5 t -123.17 135.46 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.031 1.333 . . . . 0.0 109.989 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 91.9 t -131.03 144.14 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.584 1.154 . . . . 0.0 110.526 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.3 mp -128.54 123.53 59.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 127.5 2.32 . . . . 0.0 110.184 -169.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.8 mt -83.16 160.82 21.75 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.082 0.944 . . . . 0.0 112.368 175.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.14 62.81 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.899 1.279 . . . . 0.0 113.604 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -93.72 16.17 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.201 1.801 . . . . 0.0 112.555 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 68.97 11.62 63.67 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.658 -1.276 . . . . 0.0 115.279 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.69 143.66 34.4 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.7 mm -132.84 143.41 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.193 1.397 . . . . 0.0 108.847 -171.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.1 p -53.07 127.84 46.83 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.252 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.63 127.55 12.53 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.356 2.038 . . . . 0.0 111.344 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.502 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.2 p90 -160.31 173.76 15.2 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.236 2.214 . . . . 0.0 110.433 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.2 m -135.2 145.88 48.13 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.69 0.796 . . . . 0.0 110.894 169.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -135.52 113.8 11.47 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.692 1.997 . . . . 0.0 108.997 -169.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.7 tt -104.53 146.16 29.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.611 1.564 . . . . 0.0 110.159 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.8 mtt -119.11 133.39 55.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.955 1.302 . . . . 0.0 109.595 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -131.14 139.95 49.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.513 1.525 . . . . 0.0 111.001 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 34.8 t-20 -57.35 119.44 6.47 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.127 1.371 . . . . 0.0 111.259 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.22 -17.63 58.83 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.86 -47.21 0.91 Allowed Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.657 1.122 . . . . 0.0 113.395 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.8 m -76.63 -23.63 53.36 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.978 0.911 . . . . 0.0 112.916 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 71.08 37.0 64.13 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.41 1.005 . . . . 0.0 113.858 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -137.83 136.5 20.0 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 125.203 1.401 . . . . 0.0 111.364 -169.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -53.49 149.51 30.47 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.156 3.238 . . . . 0.0 115.184 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.65 -10.72 0.81 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 176.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -167.68 157.14 10.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.459 1.904 . . . . 0.0 109.336 178.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 19.5 m -145.81 150.19 35.73 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.759 1.224 . . . . 0.0 109.114 169.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.33 138.09 54.63 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 127.369 2.268 . . . . 0.0 108.569 -178.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.0 t -134.72 136.58 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.032 0.933 . . . . 0.0 111.322 -169.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.502 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 36.9 t -120.73 149.6 42.27 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.023 1.729 . . . . 0.0 111.337 177.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.3 p -130.06 0.77 4.73 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.432 1.493 . . . . 0.0 114.276 -177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 136.52 -11.43 4.04 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.456 1.027 . . . . 0.0 115.46 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 89.3 p -156.62 160.29 39.26 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 119.039 1.42 . . . . 0.0 114.022 -172.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 48.7 t-105 -57.39 137.72 81.34 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.832 1.653 . . . . 0.0 114.759 177.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -98.51 176.36 7.94 Favored 'Cis proline' 0 CA--C 1.549 1.232 0 CA-C-N 120.155 1.091 . . . . 0.0 111.376 -10.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.9 mp -71.35 165.13 24.38 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.168 -0.957 . . . . 0.0 110.823 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -120.33 135.48 55.0 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.15 1.38 . . . . 0.0 111.663 -176.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -88.49 149.91 23.4 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.173 1.389 . . . . 0.0 112.054 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.1 t -153.59 170.42 20.86 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.386 1.874 . . . . 0.0 110.66 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.8 mp -101.43 136.77 40.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.111 0.964 . . . . 0.0 108.83 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 35.94 54.82 0.96 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.339 1.856 . . . . 0.0 114.81 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 51.2 ptt85 43.52 33.82 0.7 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.106 2.563 . . . . 0.0 117.015 -177.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.28 -31.5 67.53 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 59.7 p -79.7 -5.18 54.67 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 172.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -137.4 75.76 44.79 Favored Pre-proline 0 N--CA 1.476 0.833 0 C-N-CA 125.614 1.566 . . . . 0.0 112.311 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo . . . . . 0 C--O 1.25 1.115 0 C-N-CA 124.661 3.574 . . . . 0.0 114.293 169.628 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.37 -48.93 65.29 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.934 1.694 . . . . 0.0 113.804 171.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.4 t -73.72 -45.84 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-O 118.6 -0.714 . . . . 0.0 109.948 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.21 -44.38 83.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.607 1.094 . . . . 0.0 112.673 -178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -62.49 -44.25 96.83 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.082 -1.011 . . . . 0.0 111.93 174.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.53 -50.5 72.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.012 0.525 . . . . 0.0 111.111 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -62.54 -37.44 86.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.193 0.997 . . . . 0.0 112.61 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.01 -46.47 89.37 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.128 0.876 . . . . 0.0 111.333 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.74 -37.41 82.12 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.487 1.115 . . . . 0.0 111.885 -178.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -66.08 -46.9 76.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.427 0.691 . . . . 0.0 112.442 171.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 62.7 m -63.07 -35.72 81.18 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.364 1.065 . . . . 0.0 111.281 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.53 79.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.128 1.371 . . . . 0.0 113.685 172.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.83 99.3 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.349 -0.844 . . . . 0.0 111.44 172.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -63.24 -42.55 99.23 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.583 0.753 . . . . 0.0 112.326 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -60.84 -42.31 97.52 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.888 0.767 . . . . 0.0 112.397 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.0 m -60.61 -44.2 96.56 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.419 0.688 . . . . 0.0 110.723 176.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.93 -1.106 . . . . 0.0 113.418 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.61 78.8 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.179 -0.951 . . . . 0.0 112.927 175.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.6 tp -71.3 -34.68 70.83 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.701 1.2 . . . . 0.0 112.038 172.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.1 -44.36 95.92 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.911 -1.118 . . . . 0.0 111.581 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.5 -44.7 62.59 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.438 1.495 . . . . 0.0 111.592 169.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.68 -42.99 97.97 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.46 -44.45 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 119.146 0.884 . . . . 0.0 110.758 175.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.21 -14.94 29.25 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.979 1.312 . . . . 0.0 113.795 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -112.09 -25.66 9.23 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 176.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.2 -29.6 69.92 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.062 1.301 . . . . 0.0 112.748 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -68.52 -19.15 64.5 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 173.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 pp -117.45 -24.67 7.26 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -169.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.8 m -86.22 -12.92 48.39 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.81 1.82 89.83 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.185 0.834 . . . . 0.0 115.185 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -146.8 148.76 34.15 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 127.733 2.413 . . . . 0.0 107.424 171.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -44.96 147.58 1.91 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.078 2.519 . . . . 0.0 112.868 168.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.8 t -104.48 165.23 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 126.144 1.778 . . . . 0.0 108.411 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.28 176.25 30.62 Favored Glycine 0 CA--C 1.522 0.483 0 O-C-N 120.629 -1.295 . . . . 0.0 115.479 -177.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.4 mt -133.81 121.04 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 125.145 1.378 . . . . 0.0 108.256 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -86.29 148.39 25.64 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.791 1.236 . . . . 0.0 110.482 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -134.84 149.0 50.28 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.88 1.672 . . . . 0.0 112.682 -176.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.6 t -146.0 -179.02 6.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.619 2.368 . . . . 0.0 110.105 177.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -58.22 -30.42 66.47 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 -169.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.8 m -138.48 4.54 2.4 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.823 1.249 . . . . 0.0 113.801 -179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.22 168.72 24.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.072 -1.017 . . . . 0.0 112.959 -173.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 17.8 p90 -157.06 161.85 39.48 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.737 2.015 . . . . 0.0 109.397 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 47.1 ttm-85 -155.04 145.95 22.54 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.103 1.361 . . . . 0.0 110.755 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.1 mm -64.17 146.24 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.48 1.112 . . . . 0.0 110.746 171.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 93.9 mtp -135.19 150.85 50.2 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.884 1.674 . . . . 0.0 110.701 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.7 m -142.16 161.81 48.76 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 125.82 1.648 . . . . 0.0 111.387 -170.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.03 -13.11 25.77 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.023 3.148 . . . . 0.0 116.926 -178.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 35.41 -96.83 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 C-N-CA 127.28 2.371 . . . . 0.0 116.287 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 mmmt -68.15 -29.01 67.81 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -168.57 123.4 0.76 Allowed Pre-proline 0 N--CA 1.477 0.88 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -77.15 -20.76 12.57 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.529 2.819 . . . . 0.0 112.25 169.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 t -76.25 -28.79 57.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.749 1.219 . . . . 0.0 112.796 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -130.99 17.23 5.1 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.9 t-105 60.82 76.51 0.37 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.726 2.01 . . . . 0.0 113.425 169.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.94 59.67 1.67 Allowed 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.928 -1.107 . . . . 0.0 112.667 -177.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -44.49 149.4 0.39 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.503 1.921 . . . . 0.0 115.509 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.0 m -142.02 157.15 64.59 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 126.125 1.77 . . . . 0.0 111.163 170.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.56 129.05 21.45 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.815 2.343 . . . . 0.0 109.967 169.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 57.4 tp -74.63 113.11 11.51 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.82 -0.55 . . . . 0.0 109.896 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -138.22 2.5 2.31 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.079 0.952 . . . . 0.0 112.628 169.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.75 -31.2 25.68 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.605 1.962 . . . . 0.0 115.616 -169.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -136.02 26.54 3.27 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.128 1.371 . . . . 0.0 112.029 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -130.27 -12.9 3.99 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.359 1.464 . . . . 0.0 113.222 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.03 -52.92 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 129.717 3.207 . . . . 0.0 114.846 -170.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -152.11 -14.21 0.18 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.723 2.409 . . . . 0.0 113.636 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.94 -1.25 3.8 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.276 -1.515 . . . . 0.0 114.19 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 97.2 p -67.93 -16.33 64.02 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.732 1.613 . . . . 0.0 114.133 170.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -84.49 -173.31 4.65 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -68.75 -119.4 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 125.493 1.517 . . . . 0.0 114.345 175.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.8 t70 60.6 16.78 6.83 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 125.758 1.623 . . . . 0.0 112.623 -167.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 30.8 m0 -77.1 -15.1 59.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.774 1.63 . . . . 0.0 113.348 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -141.32 166.64 24.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.538 1.535 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.68 -33.21 0.26 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.688 2.395 . . . . 0.0 112.116 -176.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -87.92 1.4 54.16 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.028 1.331 . . . . 0.0 113.336 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.9 mt -120.55 166.47 13.58 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 122.979 1.371 . . . . 0.0 114.635 -170.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.5 t -145.13 139.98 27.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 129.244 3.018 . . . . 0.0 106.892 169.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -117.43 146.6 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.163 0.985 . . . . 0.0 111.262 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -139.07 157.34 46.15 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.186 1.794 . . . . 0.0 109.88 175.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.24 170.54 18.73 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 172.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -160.31 161.8 24.86 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 127.819 2.447 . . . . 0.0 109.972 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.86 -15.89 5.48 Favored 'Cis proline' 0 CA--C 1.54 0.775 0 CA-C-N 121.442 1.551 . . . . 0.0 115.65 -10.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -65.43 -176.06 0.3 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.054 1.342 . . . . 0.0 112.692 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.09 147.2 57.73 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.151 0.98 . . . . 0.0 113.071 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -76.13 90.74 1.15 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.941 3.094 . . . . 0.0 110.891 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -155.42 162.31 40.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.222 1.409 . . . . 0.0 111.478 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -74.19 54.42 0.55 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.816 2.047 . . . . 0.0 114.076 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.2 m -58.65 157.01 9.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.308 1.443 . . . . 0.0 113.509 177.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -75.17 2.16 11.55 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -149.61 163.35 25.25 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 127.201 2.2 . . . . 0.0 109.652 179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -65.66 143.13 73.44 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 121.268 1.312 . . . . 0.0 109.564 168.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -73.97 -47.39 37.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.704 -0.622 . . . . 0.0 111.287 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.9 t -83.29 135.17 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.254 1.022 . . . . 0.0 109.314 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 93.8 t -134.98 144.73 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 123.777 0.831 . . . . 0.0 111.15 -178.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.01 118.89 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.034 2.534 . . . . 0.0 109.411 -169.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.6 mt -78.61 161.51 26.92 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.081 0.943 . . . . 0.0 111.692 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.48 -27.39 66.08 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.005 1.322 . . . . 0.0 113.976 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -85.85 -8.14 58.27 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.091 1.756 . . . . 0.0 113.528 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.31 7.45 60.68 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.261 0.934 . . . . 0.0 114.669 -176.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -74.19 138.54 43.83 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.546 1.173 . . . . 0.0 108.502 169.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.1 mm -129.2 150.54 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.008 1.323 . . . . 0.0 109.235 -171.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.0 p -49.22 120.71 10.26 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 124.336 1.054 . . . . 0.0 111.778 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.16 84.44 1.51 Allowed 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.445 2.763 . . . . 0.0 111.71 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -122.01 -179.52 4.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.218 1.807 . . . . 0.0 111.878 -178.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 m -142.29 144.51 33.3 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.142 -0.974 . . . . 0.0 112.165 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.87 144.84 48.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 128.815 2.846 . . . . 0.0 108.78 -175.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -135.6 146.75 48.25 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.373 1.469 . . . . 0.0 110.688 -178.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 56.3 mtt -123.55 131.58 53.67 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 110.005 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.79 145.3 50.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.23 1.812 . . . . 0.0 110.932 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -52.99 129.75 31.57 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.531 1.132 . . . . 0.0 110.302 172.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.4 -18.32 17.17 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.377 1.992 . . . . 0.0 116.377 -174.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.4 -37.89 0.47 Allowed Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.749 -1.028 . . . . 0.0 115.222 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 48.5 p -77.72 -26.05 49.77 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.793 1.796 . . . . 0.0 112.523 171.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.24 5.19 75.98 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.78 1.181 . . . . 0.0 114.104 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.66 124.34 90.65 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.002 1.321 . . . . 0.0 111.451 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.31 142.96 78.17 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.328 2.685 . . . . 0.0 113.292 170.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.69 -35.05 4.04 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.088 0.955 . . . . 0.0 111.555 172.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.8 tp -151.47 153.78 35.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.539 1.136 . . . . 0.0 111.055 -169.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.9 m -142.79 144.72 32.7 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 125.739 1.615 . . . . 0.0 108.814 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.3 mp -124.01 137.57 54.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.599 1.96 . . . . 0.0 108.759 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.2 t -134.49 138.39 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.124 0.97 . . . . 0.0 111.113 -169.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.8 t -116.18 117.61 30.53 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.494 1.118 . . . . 0.0 111.552 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -76.31 -8.13 56.45 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 122.19 0.94 10.46 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.481 1.515 . . . . 0.0 114.376 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 82.5 p -156.92 159.39 38.06 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.174 -1.192 . . . . 0.0 113.412 -173.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -62.51 138.43 96.54 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.997 1.719 . . . . 0.0 115.074 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -94.84 174.55 13.49 Favored 'Cis proline' 0 CA--C 1.546 1.097 0 CA-C-N 119.947 1.017 . . . . 0.0 110.812 -11.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.96 153.75 43.06 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 122.269 1.033 . . . . 0.0 110.889 169.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -100.99 116.1 32.04 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.694 1.598 . . . . 0.0 110.752 -177.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.22 145.42 37.6 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.401 1.081 . . . . 0.0 111.291 176.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.8 t -147.47 148.3 31.1 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.957 1.703 . . . . 0.0 110.588 169.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -72.19 132.59 44.33 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.46 -0.775 . . . . 0.0 109.434 170.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.01 66.02 0.06 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.294 2.237 . . . . 0.0 115.836 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 32.7 mtm105 56.34 21.89 5.84 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.31 -27.39 67.28 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.978 1.717 . . . . 0.0 114.791 -177.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 69.4 p -101.52 7.2 42.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.817 1.247 . . . . 0.0 113.792 169.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 19.1 tpt85 -136.59 45.19 1.16 Allowed Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 126.362 1.865 . . . . 0.0 112.971 -173.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo . . . . . 0 C--O 1.251 1.155 0 C-N-CA 124.031 3.154 . . . . 0.0 114.068 -173.505 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.9 mmm . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 120.327 0.108 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.02 163.54 37.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.322 1.449 . . . . 0.0 111.608 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -75.31 -16.76 60.39 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 69.09 25.72 75.21 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 123.965 0.793 . . . . 0.0 114.512 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.82 32.23 2.22 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.647 1.979 . . . . 0.0 111.555 -171.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -97.65 -27.19 14.48 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -169.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.51 -39.95 81.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.052 1.296 . . . . 0.0 114.493 -169.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 t -65.6 -49.2 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.869 0.868 . . . . 0.0 110.492 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.13 -38.73 88.88 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.572 0.749 . . . . 0.0 112.418 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -62.25 -41.77 98.73 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.095 0.958 . . . . 0.0 111.224 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.5 m -63.48 -48.24 78.48 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.799 -0.563 . . . . 0.0 111.619 173.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.5 mmt-85 -61.69 -32.15 72.33 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.403 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.92 76.75 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.675 1.58 . . . . 0.0 111.848 173.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.0 mtm105 -62.2 -41.15 98.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.641 0.776 . . . . 0.0 111.73 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.11 -49.4 77.45 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -35.66 76.31 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.215 1.006 . . . . 0.0 111.484 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.18 88.11 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.57 97.82 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.084 0.856 . . . . 0.0 111.86 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.0 mtt85 -62.19 -45.57 92.78 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.63 1.172 . . . . 0.0 111.707 176.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -60.78 -44.28 97.0 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.623 0.769 . . . . 0.0 112.653 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.8 m -60.55 -43.42 97.24 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.912 0.778 . . . . 0.0 110.78 178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.83 97.07 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.975 -1.078 . . . . 0.0 113.276 172.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -32.18 73.66 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.275 -0.89 . . . . 0.0 113.115 175.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.3 tp -73.56 -33.72 64.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.204 1.401 . . . . 0.0 111.786 172.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.82 -45.33 93.13 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.892 -1.13 . . . . 0.0 110.704 169.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 tp -52.2 -46.39 65.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.439 1.496 . . . . 0.0 111.324 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.64 96.92 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.81 -45.42 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.708 0.803 . . . . 0.0 110.689 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.06 -35.74 79.56 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.675 0.79 . . . . 0.0 112.815 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.338 1.055 . . . . 0.0 113.164 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.14 -37.88 88.97 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -177.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -70.01 -28.55 65.59 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 121.527 -0.733 . . . . 0.0 112.504 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.3 mt -80.72 -31.99 35.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.081 1.352 . . . . 0.0 112.971 178.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.4 m -82.21 -20.23 38.17 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -170.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.75 3.4 79.46 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -143.03 149.12 47.99 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.127 2.571 . . . . 0.0 107.175 172.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -45.54 143.51 5.89 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.647 2.231 . . . . 0.0 111.807 168.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 25.6 t -88.14 162.5 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.587 1.155 . . . . 0.0 108.716 173.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.93 176.63 23.13 Favored Glycine 0 N--CA 1.46 0.282 0 O-C-N 121.261 -0.9 . . . . 0.0 113.567 173.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.5 mt -137.3 117.18 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.672 1.189 . . . . 0.0 108.813 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -74.77 146.87 41.77 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.239 1.816 . . . . 0.0 110.473 170.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -145.17 133.99 22.36 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.403 1.481 . . . . 0.0 110.351 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -150.74 27.17 0.72 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.057 1.343 . . . . 0.0 113.442 -173.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.8 t0 63.08 -66.97 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 128.242 2.617 . . . . 0.0 113.867 -176.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 75.2 m -66.54 -24.34 66.36 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.909 0.884 . . . . 0.0 113.162 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.05 169.79 21.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.559 1.144 . . . . 0.0 112.048 174.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.5 p90 -153.98 164.41 38.47 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.596 2.758 . . . . 0.0 107.469 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -167.09 146.8 5.37 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.615 1.098 . . . . 0.0 112.713 172.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mm -66.29 152.89 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.473 0.709 . . . . 0.0 109.175 170.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.1 mtp -142.94 151.29 40.79 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.635 1.574 . . . . 0.0 111.96 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.66 164.0 37.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.432 1.893 . . . . 0.0 111.521 -169.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -63.15 167.7 12.1 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.753 2.302 . . . . 0.0 113.47 171.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -156.98 163.27 32.21 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.888 1.709 . . . . 0.0 110.67 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm 59.05 -44.46 0.07 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 128.303 2.641 . . . . 0.0 115.885 -169.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.8 t -155.08 141.63 13.26 Favored Pre-proline 0 N--CA 1.472 0.656 0 C-N-CA 125.794 1.637 . . . . 0.0 111.797 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -79.8 -16.93 11.26 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 C-N-CA 123.188 2.592 . . . . 0.0 112.442 169.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.8 m -77.66 -7.03 55.83 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -169.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.38 151.62 36.81 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.014 1.325 . . . . 0.0 111.48 178.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.3 t-105 -52.69 112.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.946 1.699 . . . . 0.0 112.452 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -152.78 157.42 40.77 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.518 1.527 . . . . 0.0 110.221 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -143.15 143.7 31.91 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -174.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -145.41 139.71 15.21 Favored Pre-proline 0 N--CA 1.472 0.639 0 C-N-CA 128.73 2.812 . . . . 0.0 107.717 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.45 130.83 24.67 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.521 2.147 . . . . 0.0 111.635 174.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -79.3 78.08 5.8 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.796 0.839 . . . . 0.0 110.914 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -136.08 25.98 3.27 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.375 1.47 . . . . 0.0 112.133 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -58.71 -25.04 62.49 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 171.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -149.95 -26.8 0.25 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.108 1.363 . . . . 0.0 113.779 169.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.95 24.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 125.411 1.484 . . . . 0.0 114.193 169.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.36 121.15 8.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.562 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 55.13 22.84 4.84 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -173.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -119.32 -30.71 4.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.484 1.514 . . . . 0.0 110.686 169.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.9 t -67.9 -21.14 65.16 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.979 1.712 . . . . 0.0 112.308 169.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -137.4 152.79 50.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.217 1.407 . . . . 0.0 114.54 -169.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 46.95 -34.58 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.179 1 C-N-CA 131.974 4.11 . . . . 0.0 120.882 169.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.76 -15.62 63.02 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -169.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -68.43 -15.07 63.42 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -146.53 171.09 15.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.374 1.07 . . . . 0.0 113.696 -176.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -142.9 17.87 1.96 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.746 1.618 . . . . 0.0 112.582 172.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -144.53 0.59 1.01 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -168.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.8 mt -121.88 161.27 23.1 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -168.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.3 m -130.61 136.26 48.68 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.991 2.916 . . . . 0.0 106.685 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.93 141.53 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 125.01 1.324 . . . . 0.0 110.516 -169.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -139.08 153.42 48.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.52 1.528 . . . . 0.0 109.29 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.57 171.07 16.72 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 172.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.33 154.97 28.3 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 127.634 2.374 . . . . 0.0 109.707 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.94 -10.93 27.07 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 CA-C-N 121.368 1.524 . . . . 0.0 114.633 0.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -67.84 -171.43 0.21 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.27 1.428 . . . . 0.0 110.988 169.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.3 147.44 43.56 Favored Pre-proline 0 N--CA 1.479 0.976 0 O-C-N 120.787 -1.195 . . . . 0.0 112.82 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.1 105.23 1.15 Allowed 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.12 2.546 . . . . 0.0 109.543 174.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -160.98 137.87 8.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.885 1.274 . . . . 0.0 111.306 -169.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -69.78 46.6 0.07 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.355 2.662 . . . . 0.0 114.313 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.3 t -63.25 158.97 18.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.37 1.868 . . . . 0.0 114.159 -176.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -71.25 -5.09 29.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.974 1.31 . . . . 0.0 113.41 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -131.11 164.2 43.89 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 125.794 1.638 . . . . 0.0 111.321 176.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.02 162.12 36.78 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.45 2.1 . . . . 0.0 112.472 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -99.12 -12.22 20.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.12 1.368 . . . . 0.0 112.78 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.3 t -132.26 148.81 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 126.206 1.802 . . . . 0.0 109.398 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 73.0 t -135.49 143.09 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.77 1.228 . . . . 0.0 111.392 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -129.45 126.58 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 128.795 2.838 . . . . 0.0 109.91 -169.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.0 mt -83.98 159.81 21.16 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.123 0.963 . . . . 0.0 112.092 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.87 -26.58 67.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.2 1.4 . . . . 0.0 113.939 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -82.3 -8.6 59.64 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.651 1.58 . . . . 0.0 113.335 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.63 5.72 62.92 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.506 1.051 . . . . 0.0 114.735 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -72.01 138.83 48.23 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.507 1.154 . . . . 0.0 108.962 169.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 6.9 mm -128.05 132.9 68.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 124.558 1.143 . . . . 0.0 109.422 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.3 m -61.02 118.63 37.62 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.261 1.424 . . . . 0.0 110.431 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -52.07 132.7 44.16 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 124.017 3.144 . . . . 0.0 115.294 -176.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -162.72 174.66 12.22 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.525 1.93 . . . . 0.0 111.667 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.6 m -137.01 139.95 41.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.622 1.169 . . . . 0.0 109.463 169.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.2 tp -131.66 122.42 25.95 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.857 2.063 . . . . 0.0 109.01 -169.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.4 tt -118.78 144.58 46.2 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.265 1.826 . . . . 0.0 110.995 -169.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.1 mtt -123.54 128.3 49.55 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.093 1.357 . . . . 0.0 110.868 -176.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.16 139.13 54.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.071 1.349 . . . . 0.0 111.458 -178.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 42.5 t-20 -64.18 113.57 3.64 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.795 1.638 . . . . 0.0 110.893 -179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.59 -18.02 50.2 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -87.17 -17.23 59.49 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.721 1.153 . . . . 0.0 114.825 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.8 p -135.97 -28.74 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.171 1.485 . . . . 0.0 114.159 -169.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 89.64 -3.34 83.34 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.818 1.675 . . . . 0.0 113.885 -173.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -79.17 137.22 56.69 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 118.831 1.316 . . . . 0.0 112.496 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.96 142.4 42.55 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.898 2.399 . . . . 0.0 111.685 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.88 -35.18 5.2 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.717 0.807 . . . . 0.0 112.266 177.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.3 tp -155.74 151.55 27.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.257 1.023 . . . . 0.0 111.178 -168.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 75.6 m -139.83 152.83 46.83 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.506 1.122 . . . . 0.0 109.172 169.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.6 mt -124.66 142.53 51.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.681 2.392 . . . . 0.0 108.351 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 34.1 t -135.2 136.24 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.73 0.812 . . . . 0.0 111.969 -169.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 47.1 t -124.67 135.13 52.79 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.266 1.826 . . . . 0.0 110.919 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.1 m -131.09 7.65 4.67 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.384 1.074 . . . . 0.0 113.824 -176.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 144.73 -18.31 2.01 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.389 1.316 . . . . 0.0 116.389 172.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.3 t -157.36 155.79 31.2 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.786 1.793 . . . . 0.0 113.623 -172.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -58.59 141.8 83.75 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 115.589 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -93.18 178.34 11.88 Favored 'Cis proline' 0 CA--C 1.547 1.173 0 CA-C-N 119.757 0.949 . . . . 0.0 110.769 -11.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.89 155.77 38.65 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.107 -0.996 . . . . 0.0 111.801 169.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.07 119.81 37.36 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.231 1.412 . . . . 0.0 110.867 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -81.98 143.26 31.73 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.57 1.548 . . . . 0.0 111.323 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 3.4 t -142.75 145.01 32.87 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.013 1.325 . . . . 0.0 111.306 175.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.58 137.06 49.73 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 169.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 40.36 -97.98 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.125 1.77 . . . . 0.0 113.314 -169.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -135.35 22.18 3.43 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.524 1.53 . . . . 0.0 112.235 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.01 -21.44 21.4 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -169.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 1.2 t -120.8 11.97 11.24 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 73.91 71.34 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 125.117 1.367 . . . . 0.0 111.628 -170.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 C--O 1.251 1.132 0 C-N-CA 124.738 3.625 . . . . 0.0 114.685 175.358 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 tpt . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.545 0.212 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.05 175.09 1.31 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.949 1.299 . . . . 0.0 113.863 175.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -61.29 -22.48 64.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.699 1.2 . . . . 0.0 114.189 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.79 -38.39 0.02 OUTLIER Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.186 0.898 . . . . 0.0 114.497 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -152.31 152.84 32.62 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.097 1.359 . . . . 0.0 110.974 176.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.26 -36.6 0.65 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.408 1.883 . . . . 0.0 113.342 -175.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.34 -38.75 84.78 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.316 0.962 . . . . 0.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -63.86 -46.21 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.875 0.87 . . . . 0.0 110.679 173.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -41.75 97.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.36 0.527 . . . . 0.0 112.231 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -63.3 -44.98 93.45 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.398 0.999 . . . . 0.0 111.913 173.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -58.42 -53.04 62.81 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.308 0.643 . . . . 0.0 110.807 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.4 mmp_? -62.0 -32.96 73.48 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.299 1.039 . . . . 0.0 113.049 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.69 -50.98 69.0 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.186 1.357 . . . . 0.0 111.42 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -67.06 -36.06 81.2 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.803 -0.561 . . . . 0.0 111.455 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -63.48 -44.69 93.69 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 169.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.4 m -58.22 -41.17 83.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.361 -0.837 . . . . 0.0 111.075 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.91 -40.48 91.51 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.26 97.63 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.349 0.977 . . . . 0.0 111.954 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -62.63 -44.09 97.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.932 1.293 . . . . 0.0 111.405 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -59.27 -44.82 92.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.489 0.715 . . . . 0.0 112.417 170.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -61.34 -43.12 99.41 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.079 0.854 . . . . 0.0 111.037 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.04 99.57 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 120.784 -1.197 . . . . 0.0 113.082 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.82 -32.4 73.66 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 121.317 -0.864 . . . . 0.0 113.116 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 35.3 tp -71.13 -31.98 68.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.667 1.587 . . . . 0.0 111.783 172.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.3 -44.93 93.62 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.985 -1.072 . . . . 0.0 111.135 169.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -52.88 -46.13 67.79 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.097 1.359 . . . . 0.0 111.417 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.33 96.86 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.72 -45.61 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.241 1.016 . . . . 0.0 111.016 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -60.18 -34.48 73.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.76 0.824 . . . . 0.0 112.665 177.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -80.82 -36.07 32.09 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.98 -31.18 68.53 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.63 -11.25 60.36 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 74.5 mt -114.19 -31.6 6.27 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.363 1.865 . . . . 0.0 113.42 -173.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.8 p -72.88 -20.87 61.02 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.045 1.738 . . . . 0.0 115.563 -172.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.23 -20.32 30.51 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.637 1.113 . . . . 0.0 114.313 176.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -128.38 147.02 62.08 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 127.861 2.465 . . . . 0.0 106.925 169.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -42.26 154.04 0.12 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.86 3.04 . . . . 0.0 114.511 169.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.6 162.24 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 126.119 1.768 . . . . 0.0 108.657 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.49 178.37 33.86 Favored Glycine 0 N--CA 1.468 0.828 0 CA-C-N 120.752 1.615 . . . . 0.0 115.35 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.6 124.11 53.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.737 1.215 . . . . 0.0 110.178 177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -79.39 139.87 37.61 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 126.599 1.96 . . . . 0.0 109.433 169.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -138.39 134.53 34.26 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 125.406 1.482 . . . . 0.0 108.872 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.1 t -142.76 -175.67 4.58 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.946 1.298 . . . . 0.0 111.843 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -55.69 -26.96 47.64 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -169.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.84 -5.37 1.33 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.52 175.66 13.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.621 1.168 . . . . 0.0 112.317 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 32.4 p90 -151.8 157.95 42.63 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.451 1.901 . . . . 0.0 110.138 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.5 ttp180 -159.26 134.15 8.1 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.804 1.242 . . . . 0.0 112.39 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.2 mt -68.21 147.01 12.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 123.811 0.844 . . . . 0.0 110.114 176.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 84.4 mtp -135.99 154.46 51.07 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.942 1.697 . . . . 0.0 111.249 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 m -146.85 165.23 20.02 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 126.16 1.784 . . . . 0.0 111.256 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -62.93 159.14 39.53 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.168 1.912 . . . . 0.0 111.184 169.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -152.87 -62.16 0.01 OUTLIER Glycine 0 N--CA 1.475 1.235 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -65.63 -29.43 70.01 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.313 1.056 . . . . 0.0 113.625 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 t -154.1 137.64 10.54 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 125.102 1.361 . . . . 0.0 110.375 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -80.75 2.62 8.41 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.127 3.218 . . . . 0.0 113.193 170.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.0 m -122.43 -2.25 9.0 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -148.01 153.52 39.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.205 1.002 . . . . 0.0 111.914 173.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.8 t-105 -53.14 105.56 0.13 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.858 1.663 . . . . 0.0 114.331 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.479 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.8 tpm_? -156.05 159.01 38.75 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.999 1.72 . . . . 0.0 110.207 169.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.479 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 96.6 m95 -140.04 139.32 35.93 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.265 1.426 . . . . 0.0 112.093 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.51 154.87 73.79 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 126.907 2.083 . . . . 0.0 109.411 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.47 136.27 36.15 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.531 2.154 . . . . 0.0 112.616 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.72 -16.95 64.25 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.842 1.257 . . . . 0.0 112.869 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -48.36 -18.94 0.26 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.319 1.848 . . . . 0.0 113.438 168.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -50.75 -28.62 9.57 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.796 1.239 . . . . 0.0 113.883 169.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -139.71 0.26 1.8 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 117.119 2.266 . . . . 0.0 117.119 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.39 57.57 1.8 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.706 1.203 . . . . 0.0 109.515 169.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.68 -27.27 0.47 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 118.266 2.691 . . . . 0.0 118.266 -169.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -129.73 2.89 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 114.576 1.324 . . . . 0.0 114.576 -174.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -127.11 -13.06 5.73 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.533 1.133 . . . . 0.0 113.634 -178.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 52.1 p -73.66 -10.72 59.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.93 1.292 . . . . 0.0 114.411 172.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -121.18 177.25 5.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.031 1.732 . . . . 0.0 111.482 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -54.17 126.29 22.35 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.04 0.924 . . . . 0.0 112.954 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -157.49 29.94 0.28 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 128.993 2.917 . . . . 0.0 107.41 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -112.83 -9.32 13.67 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -167.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.39 170.21 16.42 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.391 1.076 . . . . 0.0 113.552 -175.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -138.92 2.46 2.15 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.71 1.204 . . . . 0.0 114.246 173.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -156.47 17.02 0.33 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.131 0.972 . . . . 0.0 113.444 -169.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.52 157.16 32.64 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.345 -1.472 . . . . 0.0 113.086 -169.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.8 t -135.82 142.85 44.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.854 2.062 . . . . 0.0 109.063 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.99 147.18 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.597 1.159 . . . . 0.0 111.14 -169.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -137.22 162.47 33.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.092 1.757 . . . . 0.0 110.264 173.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 73.6 mt -127.91 158.73 37.02 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.14 139.93 13.56 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 125.684 1.594 . . . . 0.0 109.227 169.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -76.4 -7.59 27.93 Favored 'Cis proline' 0 CA--C 1.545 1.043 0 CA-C-N 121.537 1.585 . . . . 0.0 113.399 -8.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -62.96 177.94 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.262 1.425 . . . . 0.0 112.167 169.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -135.78 146.68 58.1 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.6 1.16 . . . . 0.0 113.352 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -81.57 107.05 1.75 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.439 2.759 . . . . 0.0 110.115 169.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -157.77 160.01 37.39 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.087 0.955 . . . . 0.0 112.342 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.99 38.43 0.11 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 127.468 2.307 . . . . 0.0 114.02 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.8 m -59.4 156.62 12.56 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.008 1.723 . . . . 0.0 114.353 -175.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -69.6 -0.98 7.63 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.402 1.481 . . . . 0.0 114.629 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -143.58 165.19 26.28 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 127.448 2.299 . . . . 0.0 110.278 -176.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.72 155.82 64.95 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.172 1.915 . . . . 0.0 111.965 169.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -91.24 -14.95 30.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.663 1.185 . . . . 0.0 112.493 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.3 t -132.46 139.22 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 126.103 1.761 . . . . 0.0 109.078 177.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 83.1 t -133.09 147.53 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 119.443 1.02 . . . . 0.0 112.227 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -126.86 116.43 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 128.66 2.784 . . . . 0.0 108.942 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -70.83 160.32 32.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.209 1.804 . . . . 0.0 111.981 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.97 -7.05 10.03 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -121.67 10.67 10.38 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 0.0 112.992 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.95 7.86 63.91 Favored Glycine 0 CA--C 1.535 1.331 0 N-CA-C 115.963 1.145 . . . . 0.0 115.963 173.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -75.65 150.95 37.84 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.947 1.373 . . . . 0.0 107.801 169.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.5 mm -130.41 143.61 40.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 124.531 1.132 . . . . 0.0 108.939 -172.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 p -52.05 118.89 13.01 Favored Pre-proline 0 N--CA 1.473 0.699 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.1 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.78 115.06 2.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.016 2.477 . . . . 0.0 112.811 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.492 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.8 p90 -155.03 179.14 9.43 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.006 1.323 . . . . 0.0 112.908 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.9 p -143.24 152.91 42.25 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 125.331 1.452 . . . . 0.0 110.883 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.45 119.21 17.2 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 127.265 2.226 . . . . 0.0 108.806 -169.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.2 tt -110.94 145.86 37.62 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.349 1.46 . . . . 0.0 110.353 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 42.9 mtt -127.29 129.99 48.71 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.816 1.247 . . . . 0.0 110.355 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -129.99 141.71 50.72 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.528 1.531 . . . . 0.0 112.192 -171.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -61.05 109.92 1.22 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.321 1.849 . . . . 0.0 110.925 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -18.22 57.03 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -177.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.59 -16.47 68.38 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.314 0.959 . . . . 0.0 114.561 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.8 m -130.53 -27.53 2.15 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.706 1.253 . . . . 0.0 113.64 -169.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.83 36.86 40.77 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.1 0.857 . . . . 0.0 113.09 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -131.83 129.05 21.82 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.221 1.409 . . . . 0.0 111.071 -170.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.54 148.54 52.76 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.841 3.027 . . . . 0.0 114.914 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.12 -38.94 2.97 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.109 1.364 . . . . 0.0 110.973 169.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 39.9 tp -148.58 152.51 36.91 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 126.256 1.822 . . . . 0.0 110.151 -168.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.2 m -145.15 148.88 34.07 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 124.452 1.101 . . . . 0.0 108.931 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.6 mp -117.98 146.55 43.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 127.253 2.221 . . . . 0.0 108.405 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.23 141.67 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.122 0.969 . . . . 0.0 111.298 -174.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.492 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 21.9 t -120.38 121.25 38.15 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.94 1.696 . . . . 0.0 111.662 -176.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 61.7 p -74.94 -14.52 60.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.76 1.224 . . . . 0.0 114.004 170.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.33 2.77 4.02 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 125.786 1.66 . . . . 0.0 114.449 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.7 t -152.91 161.09 42.98 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.956 1.378 . . . . 0.0 113.136 -175.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -46.98 144.81 3.62 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 127.435 2.294 . . . . 0.0 113.774 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -107.87 17.25 6.93 Favored 'Cis proline' 0 CA--C 1.55 1.312 0 CA-C-N 120.744 1.301 . . . . 0.0 114.381 -2.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp 74.29 168.49 0.3 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 127.696 2.398 . . . . 0.0 112.405 -169.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -129.14 135.78 49.33 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.514 1.126 . . . . 0.0 111.558 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -82.68 155.77 24.18 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.725 1.21 . . . . 0.0 112.82 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 10.9 t -151.23 140.66 21.5 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.607 1.963 . . . . 0.0 109.976 169.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.61 130.63 43.63 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.389 -0.82 . . . . 0.0 109.383 169.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.07 63.2 0.27 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.376 1.871 . . . . 0.0 115.381 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 47.72 24.01 0.5 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 117.737 2.495 . . . . 0.0 117.737 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -57.67 -28.91 64.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -175.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.5 p -91.41 -8.15 48.7 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 175.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -63.95 -39.71 47.85 Favored Pre-proline 0 N--CA 1.478 0.975 0 CA-C-O 115.95 -1.976 . . . . 0.0 115.019 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo . . . . . 0 C--O 1.251 1.127 0 C-N-CA 124.09 3.194 . . . . 0.0 115.296 177.425 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 121.364 0.602 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.66 -172.18 0.34 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.859 1.664 . . . . 0.0 113.188 171.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -59.71 -7.84 1.77 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.077 1.751 . . . . 0.0 115.496 178.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -150.25 158.13 27.53 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 126.076 1.798 . . . . 0.0 111.076 170.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -64.19 71.66 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 127.655 2.382 . . . . 0.0 114.67 -169.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -50.16 -37.92 36.93 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.201 1.401 . . . . 0.0 112.822 171.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.46 -14.68 5.26 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.734 2.413 . . . . 0.0 114.761 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.2 t -118.13 -41.61 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.334 1.454 . . . . 0.0 110.514 170.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.39 79.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.301 0.955 . . . . 0.0 113.531 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -57.06 -34.93 68.75 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.188 0.904 . . . . 0.0 113.284 176.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.8 m -81.84 -49.85 9.89 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.183 0.993 . . . . 0.0 111.053 174.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -67.28 -26.67 66.66 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.9 -43.94 94.46 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.719 1.145 . . . . 0.0 111.812 169.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -67.19 -37.88 84.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.887 0.875 . . . . 0.0 110.922 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -63.06 -46.15 88.82 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.6 m -58.74 -40.91 85.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.934 0.893 . . . . 0.0 111.242 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.34 92.98 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.573 1.149 . . . . 0.0 113.297 174.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.53 96.86 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.801 . . . . 0.0 112.056 173.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.7 mtt85 -62.75 -45.65 91.7 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.561 1.144 . . . . 0.0 111.553 175.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -57.95 -45.33 86.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.727 0.811 . . . . 0.0 112.559 170.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.6 m -62.01 -43.29 99.14 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.886 0.766 . . . . 0.0 111.02 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.16 96.65 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.869 -1.144 . . . . 0.0 112.968 172.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.56 -32.14 73.57 Favored 'General case' 0 CA--C 1.547 0.842 0 O-C-N 121.346 -0.846 . . . . 0.0 113.269 175.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 tp -72.51 -34.68 67.78 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.879 1.272 . . . . 0.0 111.74 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.42 -45.09 94.68 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.969 -1.082 . . . . 0.0 110.778 169.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.89 -46.54 64.57 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.325 1.45 . . . . 0.0 110.921 169.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.16 -39.54 94.97 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.62 -46.33 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.833 0.853 . . . . 0.0 110.784 174.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.08 -38.17 87.8 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.137 0.575 . . . . 0.0 112.525 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -68.18 -34.15 75.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.402 1.081 . . . . 0.0 112.281 175.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -24.67 64.15 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.9 t -83.46 -12.32 56.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.262 0.937 . . . . 0.0 112.884 173.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.88 -27.57 9.64 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.367 1.067 . . . . 0.0 113.559 -174.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.0 m -85.12 -20.74 29.84 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.59 0.59 89.28 Favored Glycine 0 CA--C 1.542 1.724 0 N-CA-C 115.233 0.853 . . . . 0.0 115.233 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -142.35 151.11 57.22 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 127.611 2.364 . . . . 0.0 107.168 169.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -47.05 157.46 0.58 Allowed 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.912 2.408 . . . . 0.0 113.0 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 78.2 t -120.02 158.99 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.173 1.389 . . . . 0.0 108.904 -173.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.39 174.51 30.55 Favored Glycine 0 CA--C 1.519 0.327 0 O-C-N 121.316 -0.865 . . . . 0.0 115.102 -177.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.5 122.2 47.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 C-N-CA 124.774 1.23 . . . . 0.0 107.817 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -90.55 146.12 24.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.345 1.458 . . . . 0.0 110.579 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -140.88 131.71 25.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.977 1.711 . . . . 0.0 110.572 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 82.5 p -148.82 169.56 20.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.792 1.237 . . . . 0.0 112.495 175.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.14 -29.53 68.71 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 171.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 51.8 m -76.46 -49.88 15.48 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.262 1.025 . . . . 0.0 112.626 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.19 173.22 9.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.903 1.681 . . . . 0.0 112.1 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 38.5 p90 -127.62 147.43 50.36 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.328 1.451 . . . . 0.0 109.101 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.8 ptt-85 -155.62 147.54 23.32 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.31 1.044 . . . . 0.0 113.088 -169.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.5 mm -78.71 140.56 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.055 0.942 . . . . 0.0 109.209 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.7 mtp -136.17 148.53 48.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.164 0.986 . . . . 0.0 112.932 -177.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.6 m -143.79 169.67 9.92 Favored Pre-proline 0 N--CA 1.477 0.91 0 C-N-CA 127.709 2.404 . . . . 0.0 111.158 -169.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -54.81 -41.84 74.36 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.99 2.46 . . . . 0.0 114.312 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.87 -65.47 0.02 OUTLIER Glycine 0 CA--C 1.537 1.454 0 C-N-CA 127.624 2.535 . . . . 0.0 115.767 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -68.48 -54.63 15.66 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.28 1.432 . . . . 0.0 112.31 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.4 t -161.23 143.32 9.04 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 124.459 1.104 . . . . 0.0 112.296 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -79.93 -16.78 11.16 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 123.458 2.772 . . . . 0.0 112.789 169.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.8 m -73.92 -13.0 60.83 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -169.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -150.27 153.07 35.53 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.281 1.433 . . . . 0.0 111.031 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -58.24 113.18 1.82 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.859 1.264 . . . . 0.0 111.798 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.477 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.5 tpm_? -154.07 161.36 41.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.346 1.458 . . . . 0.0 110.174 174.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.477 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 92.7 m95 -139.8 139.64 36.45 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.991 1.316 . . . . 0.0 112.199 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.9 t -143.84 141.9 19.49 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 107.149 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.415 ' C ' ' H ' ' A' ' 65' ' ' GLN . 56.6 Cg_endo -61.84 146.97 96.19 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 121.679 1.586 . . . . 0.0 111.065 170.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.4 tp -66.98 10.91 0.12 Allowed 'General case' 0 CA--C 1.555 1.155 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 63' ' ' PRO . 41.5 mt-30 -61.85 -18.94 61.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.408 1.483 . . . . 0.0 112.729 178.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -62.05 -20.93 64.48 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.131 1.372 . . . . 0.0 113.987 171.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -146.27 -20.88 0.44 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 -175.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -111.41 11.86 21.5 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.493 1.117 . . . . 0.0 112.724 172.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.29 -169.25 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.181 2.192 . . . . 0.0 114.467 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -59.8 -11.11 4.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -68.37 -8.97 44.84 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.52 1.528 . . . . 0.0 113.763 170.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.0 m -63.64 8.87 0.07 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.609 1.964 . . . . 0.0 115.938 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -156.05 162.24 40.32 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.953 1.301 . . . . 0.0 114.113 -169.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.5 ' ND2' ' H ' ' A' ' 75' ' ' ASP . 7.2 t30 48.48 -158.36 0.06 Allowed 'General case' 0 CA--C 1.561 1.392 0 C-N-CA 126.902 2.081 . . . . 0.0 115.689 169.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.5 ' H ' ' ND2' ' A' ' 74' ' ' ASN . 1.0 OUTLIER 56.75 -6.76 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 120.669 3.581 . . . . 0.0 120.669 168.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -60.39 -21.13 61.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.853 1.661 . . . . 0.0 114.21 173.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -129.32 159.33 36.49 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.336 1.855 . . . . 0.0 112.244 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -141.88 18.53 2.14 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.37 1.068 . . . . 0.0 113.545 169.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.05 4.49 0.47 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.783 1.233 . . . . 0.0 113.993 -172.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -125.71 170.83 11.15 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.279 1.832 . . . . 0.0 111.5 -171.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 21.4 t -136.82 141.52 42.88 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.432 1.893 . . . . 0.0 109.123 169.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.64 145.6 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.348 1.459 . . . . 0.0 111.198 -169.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -141.05 152.31 44.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.197 1.799 . . . . 0.0 110.567 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.6 mt -118.96 144.8 46.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.211 1.004 . . . . 0.0 111.439 171.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -172.81 114.44 0.37 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 127.217 2.207 . . . . 0.0 110.585 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.74 156.4 4.28 Favored 'Cis proline' 0 N--CA 1.452 -0.922 0 CA-C-N 121.363 1.523 . . . . 0.0 115.586 -10.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 79.31 -171.8 0.05 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 130.299 3.44 . . . . 0.0 110.947 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.65 148.41 43.03 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 124.183 0.993 . . . . 0.0 113.078 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.06 84.86 1.91 Allowed 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.787 2.991 . . . . 0.0 111.39 175.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -142.71 142.83 32.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.93 1.292 . . . . 0.0 111.148 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -71.74 66.06 0.52 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.537 1.535 . . . . 0.0 114.155 -173.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.5 t -67.15 156.64 35.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.603 1.961 . . . . 0.0 113.661 -178.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -69.25 -8.4 45.58 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.32 1.448 . . . . 0.0 113.451 171.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -136.49 163.61 48.61 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 126.204 1.801 . . . . 0.0 111.368 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -69.88 145.47 56.52 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 121.814 1.676 . . . . 0.0 110.477 168.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.01 -49.4 24.49 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.043 0.537 . . . . 0.0 110.957 171.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.4 t -89.8 135.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.962 1.305 . . . . 0.0 109.663 -177.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.2 t -132.89 145.6 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.906 0.882 . . . . 0.0 111.644 -176.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -127.81 136.33 60.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 128.445 2.698 . . . . 0.0 109.279 -169.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.6 mt -104.97 161.37 14.26 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.772 0.796 . . . . 0.0 112.074 170.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.44 -22.17 41.7 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -170.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -103.59 5.13 36.38 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.952 1.301 . . . . 0.0 113.781 -177.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.51 8.74 57.19 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 115.552 0.981 . . . . 0.0 115.552 172.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -84.45 139.43 32.2 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.211 1.505 . . . . 0.0 108.161 169.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.9 mm -130.9 154.65 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 125.461 1.504 . . . . 0.0 109.858 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.1 p -55.73 127.93 68.46 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.857 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.74 126.85 11.08 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 122.203 1.935 . . . . 0.0 111.047 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.501 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.5 p90 -160.38 -177.41 6.21 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.905 1.682 . . . . 0.0 112.069 -177.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.58 148.68 39.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.698 0.799 . . . . 0.0 111.165 170.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.0 tp -133.17 120.35 21.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 127.929 2.492 . . . . 0.0 108.257 -170.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.5 tt -115.32 146.14 41.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.525 1.13 . . . . 0.0 110.413 -174.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 48.4 mtt -128.3 140.43 51.88 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 125.404 1.481 . . . . 0.0 109.561 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.09 147.59 49.58 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.742 1.217 . . . . 0.0 111.481 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -61.41 122.39 15.06 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.312 1.045 . . . . 0.0 109.838 173.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.18 -21.31 64.99 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -171.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -96.64 -28.57 8.83 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-N 119.119 0.872 . . . . 0.0 114.219 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 79.6 p -93.01 -27.94 16.7 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.682 1.241 . . . . 0.0 112.969 176.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.96 7.93 72.01 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.695 1.14 . . . . 0.0 113.354 -169.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -89.36 135.23 31.42 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.972 1.309 . . . . 0.0 111.401 -174.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.55 142.43 17.98 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 123.78 2.987 . . . . 0.0 113.517 172.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -131.86 -47.12 0.94 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 110.993 -169.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -144.64 156.61 44.19 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.069 1.748 . . . . 0.0 108.79 177.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 91.4 m -146.55 146.93 30.66 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 110.031 173.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.7 mp -123.49 146.99 47.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 127.431 2.293 . . . . 0.0 109.08 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 11.7 t -141.01 136.33 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.255 0.622 . . . . 0.0 111.912 -171.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.501 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.2 t -116.74 116.74 28.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.636 1.574 . . . . 0.0 110.594 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.8 p -78.19 -12.67 60.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.929 1.292 . . . . 0.0 114.295 173.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 131.7 -0.05 4.94 Favored Glycine 0 CA--C 1.538 1.494 0 C-N-CA 125.312 1.434 . . . . 0.0 114.701 -177.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.3 p -153.81 157.66 39.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.794 1.297 . . . . 0.0 113.648 -176.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -58.81 136.61 87.02 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 126.332 1.853 . . . . 0.0 115.135 177.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -96.14 176.27 10.26 Favored 'Cis proline' 0 CA--C 1.548 1.212 0 CA-C-N 120.193 1.105 . . . . 0.0 110.584 -11.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.21 153.18 44.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.93 -1.107 . . . . 0.0 111.73 169.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -81.14 170.47 16.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.118 1.367 . . . . 0.0 110.474 169.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -138.22 147.28 43.59 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.05 1.74 . . . . 0.0 111.391 176.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.5 t -150.41 150.12 30.96 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.552 1.541 . . . . 0.0 110.946 173.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.37 137.2 44.56 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 30.05 59.28 0.19 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.203 2.201 . . . . 0.0 115.565 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.255 23.4 ptt85 47.1 28.26 0.91 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 127.594 2.358 . . . . 0.0 117.215 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.41 -31.94 68.18 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.8 p -89.6 -2.12 58.22 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 173.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.3 86.33 19.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 125.436 1.494 . . . . 0.0 111.245 -169.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo . . . . . 0 C--O 1.25 1.09 0 C-N-CA 123.602 2.868 . . . . 0.0 113.102 169.872 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.94 174.89 13.08 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.024 1.33 . . . . 0.0 112.112 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 47.9 p90 -60.71 164.18 4.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.736 1.614 . . . . 0.0 113.84 176.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.47 -21.02 0.14 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.428 1.013 . . . . 0.0 114.574 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -144.23 149.56 36.55 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.835 1.654 . . . . 0.0 110.958 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -143.56 -16.76 0.63 Allowed 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 -173.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -65.4 -32.48 74.13 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.235 1.38 . . . . 0.0 112.613 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.11 -46.8 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.147 169.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.95 -41.98 99.67 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.024 0.829 . . . . 0.0 112.387 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -62.08 -47.52 84.28 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.763 0.825 . . . . 0.0 112.589 173.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.6 m -61.28 -52.01 66.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 122.868 0.467 . . . . 0.0 110.833 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -63.05 -34.69 78.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.404 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.62 67.84 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.657 1.571 . . . . 0.0 111.389 174.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -66.29 -42.62 88.11 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -60.52 -44.5 95.99 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.401 0.68 . . . . 0.0 112.15 171.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.9 m -57.64 -44.19 85.44 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.285 0.948 . . . . 0.0 111.424 174.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.4 -43.65 98.31 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.86 -44.05 94.29 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.645 -0.659 . . . . 0.0 112.246 175.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -65.43 -44.19 88.13 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.71 -0.619 . . . . 0.0 111.495 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.0 -41.73 92.73 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.529 0.732 . . . . 0.0 111.984 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.5 m -60.49 -42.97 97.4 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.069 0.85 . . . . 0.0 111.473 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.72 -40.71 92.47 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.833 -1.167 . . . . 0.0 113.225 173.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.97 -31.59 72.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.039 0.936 . . . . 0.0 113.005 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.0 tp -70.44 -36.85 74.19 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.789 1.236 . . . . 0.0 111.399 172.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -62.8 -44.88 94.99 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 121.056 -1.027 . . . . 0.0 111.8 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -54.07 -46.18 71.93 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.722 1.209 . . . . 0.0 111.796 170.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.49 -41.77 86.08 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 174.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.4 mt -62.41 -47.12 94.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 119.274 0.943 . . . . 0.0 110.512 173.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.05 -24.54 67.15 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.363 1.065 . . . . 0.0 113.775 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.06 -30.71 12.89 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -27.58 66.85 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 120.218 1.372 . . . . 0.0 113.691 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -74.13 -25.43 59.76 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.25 -27.45 13.19 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.38 1.072 . . . . 0.0 113.63 -173.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.7 m -86.84 -7.67 58.01 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.58 -3.06 80.5 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 124.592 1.091 . . . . 0.0 115.522 172.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -146.37 151.96 45.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 127.83 2.452 . . . . 0.0 107.294 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -42.12 153.01 0.14 Allowed 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 124.375 3.383 . . . . 0.0 115.303 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 74.3 t -110.78 162.51 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 126.331 1.852 . . . . 0.0 108.822 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.28 176.24 35.29 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 116.611 1.404 . . . . 0.0 116.611 -175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 4.4 mp -135.24 131.01 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 125.378 1.471 . . . . 0.0 109.331 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -95.32 148.47 22.39 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.123 1.369 . . . . 0.0 110.928 173.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -138.79 143.36 38.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.079 1.752 . . . . 0.0 111.022 -173.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 77.8 p -142.05 176.37 9.01 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.734 1.614 . . . . 0.0 111.569 -173.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.94 -32.15 52.77 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.09 1.57 2.04 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -171.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.68 174.8 14.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.935 1.294 . . . . 0.0 112.598 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -143.02 159.99 41.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 127.044 2.138 . . . . 0.0 108.569 173.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -152.49 150.72 29.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.88 144.04 12.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.772 0.829 . . . . 0.0 110.431 176.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -135.39 147.89 49.19 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.754 1.622 . . . . 0.0 110.958 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.6 m -140.75 161.91 51.68 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 125.063 1.345 . . . . 0.0 110.875 -170.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -49.76 144.74 19.56 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.238 2.625 . . . . 0.0 114.751 177.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.39 -156.42 7.87 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.017 1.294 . . . . 0.0 114.145 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -53.46 -22.1 7.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -173.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.8 t -146.96 143.61 18.64 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.922 1.289 . . . . 0.0 112.158 -177.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.68 -10.98 12.94 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 123.66 2.907 . . . . 0.0 112.372 169.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.1 t -65.03 -25.31 67.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.948 1.299 . . . . 0.0 113.907 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.52 157.92 43.77 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.45 1.5 . . . . 0.0 111.209 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 44.3 t-105 -53.23 115.44 1.9 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.646 1.578 . . . . 0.0 112.079 177.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.4 tpp85 -155.89 152.22 28.03 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.241 1.416 . . . . 0.0 110.885 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -144.1 150.82 38.73 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 26.8 m -144.17 153.89 56.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 126.237 1.815 . . . . 0.0 110.191 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.31 147.84 72.85 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.137 1.891 . . . . 0.0 110.261 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.8 tp -78.16 52.98 1.15 Allowed 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.849 0.833 . . . . 0.0 111.037 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -128.83 18.71 6.15 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.442 1.497 . . . . 0.0 113.359 -169.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -63.14 -25.07 68.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.86 0.864 . . . . 0.0 113.052 172.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -149.46 -36.71 0.16 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.711 1.204 . . . . 0.0 113.406 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.74 29.46 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.645 1.578 . . . . 0.0 113.65 171.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.4 -37.63 49.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.177 1.791 . . . . 0.0 115.018 -169.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -103.59 12.09 35.37 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.466 1.507 . . . . 0.0 112.89 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -130.27 -33.74 1.68 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.752 1.221 . . . . 0.0 113.076 -172.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 75.2 m -75.63 9.15 2.41 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.186 1.394 . . . . 0.0 114.35 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -143.61 157.08 44.69 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.699 1.2 . . . . 0.0 112.67 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 40.64 -1.32 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 170.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.12 -27.83 69.35 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 121.652 2.024 . . . . 0.0 114.588 -173.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -70.06 -17.07 63.23 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.141 1.376 . . . . 0.0 113.91 -174.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -136.68 152.39 50.34 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.607 1.563 . . . . 0.0 114.161 -169.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -141.97 -6.77 0.96 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -141.98 18.34 2.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.06 1.344 . . . . 0.0 111.972 -169.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -125.9 154.88 42.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.57 1.148 . . . . 0.0 112.824 -169.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.1 m -127.47 145.37 50.86 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 127.52 2.328 . . . . 0.0 108.518 169.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -118.04 148.67 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.592 1.157 . . . . 0.0 111.108 -169.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -138.06 151.28 47.69 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.27 1.828 . . . . 0.0 109.664 172.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.2 tt -148.02 146.03 28.74 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.893 0.877 . . . . 0.0 111.439 -174.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.69 153.63 43.28 Favored Pre-proline 0 N--CA 1.472 0.646 0 C-N-CA 125.775 1.63 . . . . 0.0 111.227 176.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -81.48 -13.31 37.45 Favored 'Cis proline' 0 CA--C 1.543 0.926 0 CA-C-N 120.542 1.229 . . . . 0.0 114.426 0.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -63.46 142.75 58.28 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.78 1.232 . . . . 0.0 112.945 -176.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -59.56 112.99 6.03 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.024 1.73 . . . . 0.0 111.67 172.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -86.03 -178.78 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.228 2.618 . . . . 0.0 112.407 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.1 t70 70.96 -44.95 0.6 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 119.104 3.001 . . . . 0.0 119.104 168.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -138.77 12.7 2.7 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -170.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.6 t -56.93 150.54 16.45 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -74.08 -11.52 60.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.898 1.279 . . . . 0.0 113.252 171.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.13 162.37 58.04 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 125.354 1.462 . . . . 0.0 111.507 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -65.14 140.28 64.45 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.503 1.468 . . . . 0.0 110.306 169.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -71.01 -22.0 62.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.668 0.787 . . . . 0.0 112.509 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 62.1 t -116.33 128.19 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.883 0.873 . . . . 0.0 109.753 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.3 t -131.18 140.84 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.478 1.111 . . . . 0.0 110.554 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -126.53 124.24 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 126.575 1.95 . . . . 0.0 110.983 -169.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.7 mt -82.69 159.59 22.58 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.172 0.987 . . . . 0.0 112.041 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.35 -25.81 62.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.966 1.306 . . . . 0.0 114.345 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -87.64 -0.37 56.78 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 113.513 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.94 10.92 80.08 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.344 -0.847 . . . . 0.0 114.323 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -79.38 142.25 36.16 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.574 -0.957 . . . . 0.0 109.232 169.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -132.65 145.85 33.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 125.239 1.416 . . . . 0.0 109.094 -169.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.5 p -52.16 135.08 40.29 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 123.842 0.857 . . . . 0.0 112.286 169.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -70.78 123.48 9.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.763 2.309 . . . . 0.0 110.658 169.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.46 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 29.0 p90 -158.6 175.61 13.43 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.094 1.358 . . . . 0.0 112.14 175.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -137.68 144.72 41.94 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.227 1.411 . . . . 0.0 108.502 169.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.8 tp -136.85 116.15 12.63 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.658 1.983 . . . . 0.0 109.215 -169.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -110.42 146.35 36.02 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.953 1.301 . . . . 0.0 110.607 -175.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.4 mtt -126.11 138.24 53.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.773 1.629 . . . . 0.0 109.293 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -139.42 149.5 44.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.126 1.37 . . . . 0.0 111.69 -174.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -63.92 118.69 8.77 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.572 0.749 . . . . 0.0 110.699 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.29 -23.45 62.43 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -85.57 -17.69 61.6 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 123.873 0.749 . . . . 0.0 114.241 175.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.1 m -118.81 -24.55 6.6 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 118.21 1.005 . . . . 0.0 113.266 -169.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 64.29 33.82 88.27 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 123.604 0.621 . . . . 0.0 112.789 -171.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -125.93 127.04 24.84 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.59 1.556 . . . . 0.0 110.379 -170.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -51.74 148.01 23.02 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.204 3.269 . . . . 0.0 115.553 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.64 -51.76 1.93 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 127.101 2.16 . . . . 0.0 111.51 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -150.64 155.37 39.23 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.776 1.631 . . . . 0.0 108.637 -169.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.0 m -145.66 138.39 25.87 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 110.052 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.1 mp -111.2 149.22 31.27 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.363 2.265 . . . . 0.0 109.795 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 28.3 t -144.42 138.25 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.696 1.198 . . . . 0.0 111.871 -169.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.46 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 14.1 t -117.28 158.18 24.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.433 1.493 . . . . 0.0 112.125 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 83.0 p -133.06 -2.02 3.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.727 1.611 . . . . 0.0 114.311 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 125.3 -14.33 7.36 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.912 1.244 . . . . 0.0 115.101 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 55.7 m -142.35 152.55 43.01 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.826 1.251 . . . . 0.0 112.436 -172.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 47.5 t-105 -53.7 134.68 55.32 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.471 1.509 . . . . 0.0 114.678 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -99.9 178.2 6.05 Favored 'Cis proline' 0 CA--C 1.55 1.276 0 CA-C-N 120.53 1.225 . . . . 0.0 111.272 -11.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.7 mp -67.76 168.6 11.11 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.191 -0.943 . . . . 0.0 112.079 169.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -114.08 164.6 13.61 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.389 1.475 . . . . 0.0 109.654 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -142.88 156.33 44.9 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.2 t -151.5 154.64 36.94 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.37 1.868 . . . . 0.0 111.084 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.01 133.82 47.64 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.494 -0.754 . . . . 0.0 109.047 169.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.82 63.1 0.13 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.646 1.978 . . . . 0.0 115.637 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 55.7 ptt85 46.46 25.77 0.43 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 127.83 2.452 . . . . 0.0 117.252 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.63 -33.62 71.74 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 -174.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.9 p -77.48 -20.95 53.59 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 20.1 mtp-105 -74.07 152.51 88.52 Favored Pre-proline 0 N--CA 1.475 0.795 0 C-N-CA 124.073 0.949 . . . . 0.0 112.768 -170.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 C--O 1.249 1.048 0 C-N-CA 123.788 2.992 . . . . 0.0 113.172 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 tpp . . . . . 0 N--CA 1.488 1.474 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.3 151.77 33.45 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.038 1.335 . . . . 0.0 111.293 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -161.14 105.99 1.35 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.958 1.703 . . . . 0.0 108.414 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -41.35 -29.52 0.4 Allowed Glycine 0 N--CA 1.482 1.715 0 C-N-CA 127.475 2.464 . . . . 0.0 118.217 -169.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.3 ttp-105 -51.76 -22.6 3.72 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.034 1.734 . . . . 0.0 113.179 169.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -51.5 -20.99 2.13 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.665 1.986 . . . . 0.0 115.511 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.16 -36.43 79.79 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.126 1.33 . . . . 0.0 112.782 170.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.8 t -70.16 -41.84 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.62 0.768 . . . . 0.0 110.127 173.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.8 -39.88 95.65 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.666 -0.646 . . . . 0.0 112.586 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -62.01 -46.34 89.62 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.682 0.793 . . . . 0.0 111.804 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.0 m -55.75 -53.81 52.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.143 0.577 . . . . 0.0 110.73 174.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.1 mmt-85 -62.12 -36.11 80.77 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 117.488 -1.244 . . . . 0.0 112.661 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.1 66.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 121.103 1.774 . . . . 0.0 111.722 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -63.87 -42.39 97.54 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.063 1.345 . . . . 0.0 111.666 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -64.79 -44.72 89.02 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.775 1.63 . . . . 0.0 112.99 174.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -62.92 -38.68 91.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.388 1.075 . . . . 0.0 111.273 175.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.09 84.24 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.57 -43.75 98.28 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.705 -0.622 . . . . 0.0 111.954 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -61.05 -48.95 79.38 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.787 1.235 . . . . 0.0 111.446 177.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -61.02 -42.29 98.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.779 -0.629 . . . . 0.0 112.399 174.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.9 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.439 1.018 . . . . 0.0 111.013 176.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.31 -42.22 99.0 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.973 -1.079 . . . . 0.0 113.396 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.1 -33.78 76.55 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.228 -0.92 . . . . 0.0 112.882 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.7 tp -71.3 -31.89 67.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.875 1.27 . . . . 0.0 111.797 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -62.97 -44.57 95.68 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.07 -1.019 . . . . 0.0 110.69 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 tp -54.02 -46.57 71.85 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.805 1.242 . . . . 0.0 111.468 169.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.0 -45.31 90.96 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.1 mt -61.98 -46.22 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 110.863 175.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -62.74 -33.37 75.0 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.933 0.893 . . . . 0.0 113.025 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -82.06 -27.03 33.18 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.247 1.019 . . . . 0.0 113.562 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.08 -38.32 85.83 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.927 1.24 . . . . 0.0 114.26 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.6 t -68.82 -32.5 72.25 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.407 -0.808 . . . . 0.0 112.144 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.86 -32.96 59.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.383 1.473 . . . . 0.0 112.804 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 75.0 m -72.23 -24.58 61.4 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.516 1.526 . . . . 0.0 114.446 -174.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.27 13.2 64.54 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 123.749 0.69 . . . . 0.0 114.153 -174.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -152.96 150.61 24.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.893 2.877 . . . . 0.0 107.178 -178.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -50.24 161.36 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.616 2.211 . . . . 0.0 112.824 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.0 t -122.55 159.65 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 125.15 1.38 . . . . 0.0 108.214 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.86 -174.8 28.02 Favored Glycine 0 N--CA 1.464 0.563 0 O-C-N 120.603 -1.31 . . . . 0.0 115.155 -176.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -125.64 127.96 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.491 1.116 . . . . 0.0 108.963 174.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -97.71 98.12 9.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.575 1.55 . . . . 0.0 108.275 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -84.85 126.55 33.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.54 1.136 . . . . 0.0 109.162 171.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 87.9 p -126.34 9.17 7.23 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -175.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 64.66 -37.46 0.21 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 128.338 2.655 . . . . 0.0 114.84 -172.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -62.66 -40.89 98.48 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.197 1.399 . . . . 0.0 111.516 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.8 -174.66 4.03 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 128.061 2.545 . . . . 0.0 109.29 169.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -147.63 135.1 20.78 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.108 -0.995 . . . . 0.0 110.492 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.37 151.28 39.07 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.769 1.228 . . . . 0.0 112.383 -173.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.1 mt -71.54 149.19 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.546 0.738 . . . . 0.0 109.142 171.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 6.0 ttt -138.55 139.53 38.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.228 1.411 . . . . 0.0 110.3 -172.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.54 164.55 30.0 Favored Pre-proline 0 N--CA 1.479 1.023 0 C-N-CA 126.492 1.917 . . . . 0.0 111.286 -169.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -68.01 164.46 31.82 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 121.787 1.658 . . . . 0.0 111.791 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.63 -59.69 0.01 OUTLIER Glycine 0 N--CA 1.472 1.066 0 CA-C-O 119.568 -0.573 . . . . 0.0 114.183 177.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -65.81 -30.78 71.46 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.272 1.036 . . . . 0.0 113.763 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.5 t -157.11 138.71 9.89 Favored Pre-proline 0 N--CA 1.471 0.616 0 C-N-CA 124.608 1.163 . . . . 0.0 110.95 169.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -87.05 4.69 6.08 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.266 3.311 . . . . 0.0 113.399 171.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.2 p -45.72 -58.54 3.38 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -162.95 -36.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.126 1.371 . . . . 0.0 113.462 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -152.84 106.22 3.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.818 0.847 . . . . 0.0 112.118 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.1 tpp85 -155.9 151.58 27.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.338 1.855 . . . . 0.0 109.607 169.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -144.54 135.83 25.36 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.7 m -143.01 151.64 56.5 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 128.255 2.622 . . . . 0.0 108.953 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.06 135.28 40.02 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 122.222 1.948 . . . . 0.0 111.095 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 tt -71.63 88.55 0.96 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.539 1.136 . . . . 0.0 109.317 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -135.74 -10.51 2.09 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -58.54 -27.68 64.76 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.651 1.114 . . . . 0.0 113.845 -177.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -135.94 24.56 3.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.454 1.902 . . . . 0.0 112.776 174.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.56 35.37 2.46 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.856 2.062 . . . . 0.0 109.718 172.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.72 118.58 4.34 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.049 1.74 . . . . 0.0 112.648 -169.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.1 t70 54.32 21.77 3.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.886 1.674 . . . . 0.0 115.101 -177.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -133.69 -12.18 2.66 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.9 t -63.87 -24.46 67.75 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.242 1.017 . . . . 0.0 113.551 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -151.6 165.61 33.77 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.762 1.225 . . . . 0.0 113.269 -177.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.74 -37.13 0.06 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 129.398 3.079 . . . . 0.0 116.66 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.91 -6.58 22.61 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.016 2.126 . . . . 0.0 113.935 173.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -42.97 -48.45 5.93 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.395 1.878 . . . . 0.0 114.574 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -158.16 -178.41 7.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.142 1.377 . . . . 0.0 112.549 -169.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -139.12 18.17 2.61 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.116 1.366 . . . . 0.0 112.922 171.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -146.93 -2.99 0.6 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.0 mt -118.08 160.08 22.12 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 -169.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.5 t -132.74 133.72 43.84 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.93 2.492 . . . . 0.0 107.802 169.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -109.66 145.62 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.542 1.137 . . . . 0.0 111.038 -169.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -136.99 155.2 50.01 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.965 1.706 . . . . 0.0 110.713 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.2 tt -145.62 147.36 31.95 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.604 1.161 . . . . 0.0 112.523 -169.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -154.03 153.44 28.49 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.282 1.833 . . . . 0.0 109.607 168.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -76.5 -13.62 27.25 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 120.84 1.336 . . . . 0.0 113.938 -2.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -67.85 173.15 4.64 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.339 1.056 . . . . 0.0 111.953 171.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.13 135.06 26.84 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.725 1.21 . . . . 0.0 112.449 -173.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.89 100.05 1.34 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.474 2.783 . . . . 0.0 109.87 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -159.93 141.85 13.02 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.321 1.449 . . . . 0.0 110.571 -171.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -59.83 87.05 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.736 1.214 . . . . 0.0 112.131 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.4 m -101.93 -6.57 23.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.361 1.864 . . . . 0.0 113.085 -169.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.0 20.97 4.63 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.729 2.011 . . . . 0.0 114.277 -177.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -157.29 163.47 24.83 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 127.244 2.218 . . . . 0.0 108.624 175.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.58 155.63 66.01 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 CA-C-N 120.26 1.129 . . . . 0.0 110.883 169.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -107.2 -44.88 4.25 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.088 0.555 . . . . 0.0 110.826 170.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.0 t -79.47 132.47 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.8 t -134.08 145.29 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.997 0.919 . . . . 0.0 111.865 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.72 131.53 72.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 C-N-CA 129.644 3.178 . . . . 0.0 107.984 -172.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.8 mt -96.43 157.72 15.77 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.279 0.562 . . . . 0.0 111.151 169.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.64 -22.73 47.29 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.28 -18.62 61.78 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.802 1.641 . . . . 0.0 113.507 174.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.36 5.18 63.75 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 124.933 1.254 . . . . 0.0 114.611 -176.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.29 144.25 29.84 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 118.323 1.062 . . . . 0.0 108.99 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 3.8 mm -131.47 150.27 34.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 125.334 1.454 . . . . 0.0 110.088 -168.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.6 p -57.59 121.91 52.13 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.685 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.36 127.98 28.22 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 122.736 2.29 . . . . 0.0 113.373 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -161.48 175.17 12.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.069 1.348 . . . . 0.0 112.558 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 79.1 p -136.42 150.02 48.56 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 123.749 0.82 . . . . 0.0 111.044 168.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.0 tp -130.38 106.35 8.49 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.795 2.038 . . . . 0.0 108.041 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -98.48 145.46 26.75 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.924 1.29 . . . . 0.0 110.022 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.2 mtt -128.67 128.96 45.13 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.905 1.682 . . . . 0.0 108.895 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.7 144.28 50.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 124.99 1.316 . . . . 0.0 110.764 -178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -69.61 104.54 2.4 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.089 1.356 . . . . 0.0 110.004 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.62 -20.98 66.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.625 1.17 . . . . 0.0 114.132 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -99.14 -7.19 55.2 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.775 1.179 . . . . 0.0 114.818 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.2 m -124.17 -29.11 3.62 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.579 1.152 . . . . 0.0 112.327 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 103.24 22.66 9.01 Favored Glycine 0 CA--C 1.534 1.275 0 N-CA-C 116.659 1.424 . . . . 0.0 116.659 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -140.18 143.46 33.8 Favored Pre-proline 0 N--CA 1.477 0.887 0 CA-C-N 119.491 1.645 . . . . 0.0 112.972 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.67 147.86 29.74 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.784 2.989 . . . . 0.0 113.503 169.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.87 -47.49 1.14 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.156 1.382 . . . . 0.0 112.513 -169.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -151.65 154.21 35.94 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.973 1.309 . . . . 0.0 108.954 -174.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 57.9 m -146.07 141.39 27.55 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 120.896 -1.127 . . . . 0.0 110.26 176.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.9 mp -113.35 148.95 34.73 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 126.589 1.955 . . . . 0.0 108.911 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.2 t -141.57 137.2 32.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.444 0.698 . . . . 0.0 111.875 -173.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.76 113.98 21.45 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.152 1.381 . . . . 0.0 110.94 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.7 m -75.52 -12.85 60.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 139.91 -3.09 2.5 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.851 1.215 . . . . 0.0 115.547 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 9.5 t -151.81 153.43 34.23 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.306 1.553 . . . . 0.0 112.87 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.5 t-105 -59.97 141.48 89.78 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 126.145 1.778 . . . . 0.0 115.244 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -91.44 176.05 17.44 Favored 'Cis proline' 0 CA--C 1.544 0.992 0 CA-C-N 119.793 0.962 . . . . 0.0 110.88 -11.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -67.96 152.69 45.14 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 122.226 1.012 . . . . 0.0 111.906 170.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.96 169.38 16.85 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.169 1.387 . . . . 0.0 109.523 169.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -137.51 147.21 45.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.339 1.456 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.2 t -152.13 154.57 36.14 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.247 1.419 . . . . 0.0 110.992 174.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.97 133.84 41.62 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 31.77 61.37 0.29 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.752 2.021 . . . . 0.0 115.551 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.305 0.0 OUTLIER 49.64 11.3 0.05 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 128.528 2.731 . . . . 0.0 118.209 -176.86 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.18 -34.07 63.54 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 3.2 m -91.68 -10.15 41.26 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.484 1.113 . . . . 0.0 113.288 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -64.97 -41.54 55.5 Favored Pre-proline 0 N--CA 1.478 0.961 0 CA-C-O 116.508 -1.711 . . . . 0.0 115.029 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo . . . . . 0 C--O 1.25 1.114 0 C-N-CA 124.317 3.345 . . . . 0.0 115.349 176.558 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.0 ptp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.66 172.42 13.02 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.437 1.495 . . . . 0.0 111.452 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -73.32 50.65 0.31 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.644 1.978 . . . . 0.0 114.273 -176.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -178.94 115.83 0.5 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 126.61 2.052 . . . . 0.0 110.395 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.0 ttm-85 48.81 41.02 17.59 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.299 1.44 . . . . 0.0 112.299 -169.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.19 -42.2 2.94 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 128.014 2.526 . . . . 0.0 113.306 170.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -153.74 -30.69 0.12 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.54 1.536 . . . . 0.0 112.594 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.75 -29.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -43.09 -53.24 5.02 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 117.299 2.333 . . . . 0.0 117.299 -167.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -65.51 -21.11 66.59 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.7 m -93.43 -51.95 4.74 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.221 1.409 . . . . 0.0 110.487 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 tpt85 -59.23 -33.81 71.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.012 2.125 . . . . 0.0 113.091 -177.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.05 95.11 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.434 1.47 . . . . 0.0 112.597 173.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -67.04 -41.67 86.15 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.464 1.106 . . . . 0.0 110.871 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.07 -41.46 99.44 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.635 0.774 . . . . 0.0 112.168 172.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.6 m -61.13 -41.6 97.02 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.406 1.082 . . . . 0.0 111.184 175.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.09 -41.14 91.07 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.54 91.52 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.517 -0.739 . . . . 0.0 111.884 173.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -58.47 -46.99 85.5 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.299 1.439 . . . . 0.0 111.038 174.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -63.58 -42.88 98.26 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.44 1.096 . . . . 0.0 112.688 177.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.7 m -61.7 -44.73 96.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 118.727 0.694 . . . . 0.0 110.864 176.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.25 -41.79 98.76 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.144 -0.972 . . . . 0.0 113.082 173.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.09 -31.33 70.87 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.263 -0.898 . . . . 0.0 113.374 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.6 tp -71.15 -32.79 69.37 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.482 1.113 . . . . 0.0 111.414 171.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.54 -44.01 95.45 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.913 -1.117 . . . . 0.0 110.644 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -44.75 68.34 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.048 1.339 . . . . 0.0 111.236 169.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.79 -40.63 97.93 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 176.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -64.09 -44.99 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.744 0.817 . . . . 0.0 110.718 173.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -60.6 -39.37 87.89 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.347 0.659 . . . . 0.0 112.56 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -32.82 63.18 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.378 -0.826 . . . . 0.0 112.126 174.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -36.29 83.38 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 120.121 1.328 . . . . 0.0 112.48 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -21.92 60.46 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.902 -0.499 . . . . 0.0 112.268 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.38 -28.79 14.3 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.638 1.175 . . . . 0.0 113.216 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.5 m -77.55 -28.87 52.0 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -172.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.42 9.32 84.46 Favored Glycine 0 CA--C 1.542 1.771 0 CA-C-N 119.12 0.873 . . . . 0.0 114.629 -172.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -140.76 144.34 35.51 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 127.89 2.476 . . . . 0.0 106.637 169.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.71 158.61 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.651 2.901 . . . . 0.0 114.785 169.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.0 t -115.57 164.92 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.867 2.067 . . . . 0.0 108.204 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -155.99 174.53 33.91 Favored Glycine 0 N--CA 1.465 0.611 0 CA-C-N 120.402 1.456 . . . . 0.0 115.788 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 138.04 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.55 1.14 . . . . 0.0 108.773 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -114.89 125.59 53.82 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.109 2.163 . . . . 0.0 109.299 -169.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -127.26 127.1 43.85 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 110.895 -171.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.5 t -147.19 167.08 25.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.028 1.331 . . . . 0.0 112.053 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.33 -28.02 67.63 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.409 1.083 . . . . 0.0 112.697 173.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 p -71.88 -54.19 10.84 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.034 1.334 . . . . 0.0 112.58 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.66 173.4 13.94 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.356 2.262 . . . . 0.0 110.336 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -136.25 153.36 51.22 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.939 0.896 . . . . 0.0 111.508 169.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.8 ptp85 -158.28 163.21 37.61 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.822 1.249 . . . . 0.0 113.955 -170.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.9 mt -92.91 144.89 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.929 0.891 . . . . 0.0 109.724 170.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 92.0 mtp -134.45 149.79 50.78 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.964 1.706 . . . . 0.0 110.645 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.0 p -141.62 156.07 66.54 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.979 1.711 . . . . 0.0 111.299 -168.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -58.31 -29.99 89.65 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.085 2.523 . . . . 0.0 114.066 169.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 67.4 -68.47 0.25 Allowed Glycine 0 CA--C 1.529 0.942 0 C-N-CA 127.466 2.46 . . . . 0.0 115.496 169.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -135.6 -20.75 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.345 1.858 . . . . 0.0 114.436 -169.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.48 48.01 3.04 Favored Pre-proline 0 N--CA 1.485 1.281 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -169.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -65.82 4.69 0.79 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 123.973 3.115 . . . . 0.0 114.741 178.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.0 m -44.88 -33.79 2.1 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 129.184 2.994 . . . . 0.0 115.573 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -154.04 -51.65 0.1 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.552 1.141 . . . . 0.0 111.749 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.8 t-105 -158.91 125.3 4.58 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.478 1.511 . . . . 0.0 110.468 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -152.65 154.13 34.71 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.234 1.413 . . . . 0.0 111.14 174.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -141.87 151.0 42.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.823 1.249 . . . . 0.0 112.534 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.3 p -159.45 149.54 15.16 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 127.992 2.517 . . . . 0.0 108.12 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.28 140.22 42.77 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.577 2.185 . . . . 0.0 112.813 169.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.74 64.27 2.98 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.272 1.029 . . . . 0.0 110.371 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.415 HE22 ' NE2' ' A' ' 73' ' ' GLN . 35.6 mt-30 -131.05 5.65 4.53 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.658 1.583 . . . . 0.0 113.086 -170.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -62.03 -18.21 59.84 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.655 1.182 . . . . 0.0 113.961 176.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -133.85 -33.09 1.07 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.162 1.385 . . . . 0.0 113.026 173.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.82 -11.94 61.05 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 174.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.32 -55.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 129.934 3.294 . . . . 0.0 116.574 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.5 -15.15 0.24 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.778 1.631 . . . . 0.0 113.894 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -62.42 -21.29 65.29 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 120.801 -1.187 . . . . 0.0 114.085 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.0 m -76.65 -2.3 32.02 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.455 1.502 . . . . 0.0 114.735 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.415 ' NE2' HE22 ' A' ' 65' ' ' GLN . 22.1 pt20 -141.22 165.42 27.58 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.107 1.322 . . . . 0.0 112.863 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 41.2 t30 47.73 -52.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 130.362 3.465 . . . . 0.0 119.684 169.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -55.46 -13.68 1.61 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 127.412 2.285 . . . . 0.0 113.442 169.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 28.6 m95 -43.07 -30.26 0.42 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 115.604 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -149.17 154.88 39.81 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.928 1.24 . . . . 0.0 112.972 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -145.62 -19.64 0.47 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -177.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -136.99 16.35 3.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.548 1.539 . . . . 0.0 111.311 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -129.61 156.45 44.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.944 1.698 . . . . 0.0 110.532 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.2 m -125.44 130.65 52.26 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.288 1.835 . . . . 0.0 109.013 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.97 139.3 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.594 1.158 . . . . 0.0 110.06 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 -137.48 122.18 18.64 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.505 1.522 . . . . 0.0 109.357 -176.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.15 145.11 42.1 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.972 1.309 . . . . 0.0 111.994 -169.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -156.62 153.48 24.78 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.364 1.865 . . . . 0.0 110.19 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -75.02 -15.22 22.56 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 CA-C-N 120.347 1.16 . . . . 0.0 113.69 -3.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -61.06 125.57 24.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.202 1.001 . . . . 0.0 111.801 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 134.72 89.61 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 124.183 0.993 . . . . 0.0 112.52 177.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.98 108.64 2.36 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.049 2.5 . . . . 0.0 109.627 172.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -159.51 145.93 16.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.473 1.109 . . . . 0.0 111.851 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.85 48.22 0.46 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.446 1.498 . . . . 0.0 112.618 174.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.8 m -58.31 156.18 10.44 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.903 1.681 . . . . 0.0 113.207 -176.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -67.8 5.09 0.93 Allowed 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -159.45 164.35 20.82 Favored Pre-proline 0 CA--C 1.542 0.649 0 C-N-CA 127.346 2.258 . . . . 0.0 109.889 -176.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.89 149.68 83.13 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 121.407 1.405 . . . . 0.0 110.01 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -94.1 -42.81 8.8 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.039 -0.413 . . . . 0.0 111.987 176.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -73.79 138.53 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.227 1.011 . . . . 0.0 109.194 169.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 85.5 t -136.13 144.94 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.717 0.807 . . . . 0.0 111.772 -176.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.45 118.0 48.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 128.885 2.874 . . . . 0.0 108.072 -173.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.7 mt -82.53 163.41 21.54 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 122.275 1.036 . . . . 0.0 111.952 177.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.88 -13.69 11.99 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -176.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -120.12 9.44 11.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.561 . . . . 0.0 113.308 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.31 9.25 58.12 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 115.788 1.075 . . . . 0.0 115.788 174.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -75.49 136.56 40.63 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.942 1.371 . . . . 0.0 108.178 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.2 mm -130.14 144.69 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.706 1.203 . . . . 0.0 109.551 -172.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.6 p -54.75 133.56 65.44 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 121.656 -0.653 . . . . 0.0 110.931 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.49 98.49 1.18 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.506 2.137 . . . . 0.0 111.466 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 22.4 p90 -124.48 177.28 6.0 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.045 1.738 . . . . 0.0 111.945 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.2 t -140.26 145.57 37.49 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.802 1.241 . . . . 0.0 110.299 172.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 7.7 tp -130.45 92.14 3.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.128 2.171 . . . . 0.0 109.602 -169.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.1 tt -80.75 143.73 32.69 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.962 0.905 . . . . 0.0 109.921 176.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 63.2 mtt -127.31 133.11 50.15 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 126.028 1.731 . . . . 0.0 108.309 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.46 143.49 51.17 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.907 1.283 . . . . 0.0 110.693 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -66.92 109.46 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.764 0.826 . . . . 0.0 110.901 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.37 64.57 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.88 -0.04 75.57 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 125.653 1.597 . . . . 0.0 114.429 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -129.85 -37.45 1.53 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.704 1.201 . . . . 0.0 113.143 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 88.49 30.18 16.82 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 118.515 0.598 . . . . 0.0 114.014 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -141.65 139.67 18.95 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.123 1.369 . . . . 0.0 111.225 -169.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -49.61 144.63 18.93 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.912 3.075 . . . . 0.0 114.182 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -130.68 -50.08 1.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 110.603 -169.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.47 162.84 33.48 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.74 1.616 . . . . 0.0 110.174 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 9.4 m -147.99 117.51 7.01 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 123.882 0.873 . . . . 0.0 109.188 176.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.5 mp -92.4 149.51 21.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.8 1.24 . . . . 0.0 109.918 173.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.07 136.45 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.417 1.087 . . . . 0.0 112.056 -169.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 18.0 t -120.62 160.26 23.61 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.905 1.682 . . . . 0.0 111.442 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 82.1 p -137.72 -0.4 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -174.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.34 -11.6 5.8 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.613 1.102 . . . . 0.0 115.004 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.2 p -157.6 158.67 36.0 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.235 -1.156 . . . . 0.0 113.513 -173.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 29.6 t-105 -60.69 140.11 92.95 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 126.309 1.843 . . . . 0.0 114.991 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -96.1 176.98 9.71 Favored 'Cis proline' 0 CA--C 1.546 1.114 0 CA-C-N 119.969 1.025 . . . . 0.0 111.281 -11.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.9 mp -69.35 168.14 14.98 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.133 0.968 . . . . 0.0 111.096 169.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -114.71 164.29 14.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.158 1.383 . . . . 0.0 109.434 169.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -140.46 149.83 43.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.362 1.065 . . . . 0.0 112.484 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.1 t -145.62 150.28 36.06 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.149 1.38 . . . . 0.0 111.181 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.85 132.19 46.35 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.781 -0.574 . . . . 0.0 109.478 169.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.91 66.37 0.07 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.472 2.309 . . . . 0.0 115.939 176.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.76 7.81 4.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 175.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -57.74 -31.28 66.32 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 116.31 1.967 . . . . 0.0 116.31 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.9 p -99.09 -6.33 28.59 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -63.64 -35.77 18.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 117.277 2.325 . . . . 0.0 117.277 -169.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo . . . . . 0 C--O 1.25 1.094 0 C-N-CA 124.111 3.207 . . . . 0.0 115.307 177.865 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.13 -11.53 6.29 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -176.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -75.22 -23.24 57.56 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.093 1.357 . . . . 0.0 113.528 173.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.25 67.51 1.47 Allowed Glycine 0 CA--C 1.532 1.132 0 C-N-CA 127.002 2.239 . . . . 0.0 115.017 -169.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -118.57 7.94 11.89 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.126 1.771 . . . . 0.0 113.241 -173.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -50.04 -37.38 32.97 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 -169.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -71.12 -41.11 70.95 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.836 1.198 . . . . 0.0 112.767 176.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 46.4 t -66.96 -45.01 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.693 0.797 . . . . 0.0 109.825 173.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.69 90.83 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.105 0.962 . . . . 0.0 112.512 176.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -63.11 -49.28 75.03 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.749 1.159 . . . . 0.0 111.671 172.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.2 m -57.77 -52.41 65.59 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.136 0.574 . . . . 0.0 110.584 177.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -65.48 -30.75 71.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.685 1.194 . . . . 0.0 113.728 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.35 -48.75 78.43 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.743 1.61 . . . . 0.0 110.778 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -66.41 -38.94 88.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.887 1.275 . . . . 0.0 111.513 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.53 -46.06 87.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.612 0.765 . . . . 0.0 112.191 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.3 m -57.56 -40.08 78.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.857 0.863 . . . . 0.0 111.27 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.06 -44.58 84.11 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.46 -43.51 97.15 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.357 -0.839 . . . . 0.0 111.913 174.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -62.15 -45.56 92.91 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.948 1.699 . . . . 0.0 111.515 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -59.13 -47.46 85.21 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.463 1.105 . . . . 0.0 112.242 170.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.5 m -58.24 -41.56 84.45 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 118.871 0.759 . . . . 0.0 110.725 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.32 -41.02 94.44 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.051 -1.031 . . . . 0.0 113.715 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.23 -32.78 74.5 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.148 -0.97 . . . . 0.0 113.094 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.3 tp -74.08 -35.11 64.2 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.848 1.259 . . . . 0.0 111.602 174.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.53 -46.25 90.75 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.994 -1.066 . . . . 0.0 111.067 169.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 tp -51.98 -47.45 64.85 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.322 1.449 . . . . 0.0 111.262 169.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.43 85.93 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.9 mt -66.05 -47.95 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.411 1.005 . . . . 0.0 110.659 174.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -59.83 -39.24 84.4 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.807 -0.558 . . . . 0.0 112.007 175.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -69.17 -38.72 78.86 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.362 -0.836 . . . . 0.0 112.391 175.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.26 73.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.449 1.022 . . . . 0.0 112.712 174.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.08 -20.41 55.79 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.687 0.676 . . . . 0.0 112.551 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.48 -27.19 14.17 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.613 1.165 . . . . 0.0 113.702 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.7 m -89.83 -14.03 35.28 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -169.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.34 -1.36 81.67 Favored Glycine 0 CA--C 1.542 1.723 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -140.83 149.98 58.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 127.861 2.464 . . . . 0.0 107.25 172.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -45.95 164.67 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 124.305 3.337 . . . . 0.0 115.528 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.8 t -123.12 159.3 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.431 1.893 . . . . 0.0 108.353 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.35 -178.79 32.71 Favored Glycine 0 N--CA 1.465 0.574 0 O-C-N 120.721 -1.237 . . . . 0.0 115.402 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.8 mt -131.27 111.95 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.42 1.088 . . . . 0.0 110.333 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -83.36 78.29 9.66 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.206 1.803 . . . . 0.0 110.269 175.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -64.99 120.36 12.46 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 168.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 t -125.99 -179.6 4.77 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.25 1.42 . . . . 0.0 113.079 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.34 -24.78 68.0 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -169.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.1 m -135.08 -9.72 2.29 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -175.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -161.16 -175.68 5.01 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.959 2.104 . . . . 0.0 109.365 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -136.6 151.48 49.38 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.302 1.041 . . . . 0.0 109.583 169.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -141.08 151.34 43.92 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.2 mm -76.65 137.33 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 169.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.1 mtm -128.89 150.4 50.37 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.049 1.34 . . . . 0.0 111.371 175.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.65 163.28 51.74 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 126.98 2.112 . . . . 0.0 111.261 -168.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -54.49 160.95 6.24 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 124.085 3.19 . . . . 0.0 114.825 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -120.22 -136.35 5.17 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.587 1.089 . . . . 0.0 113.715 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -46.54 -35.79 6.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 126.37 1.868 . . . . 0.0 114.68 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 t -146.45 142.13 17.09 Favored Pre-proline 0 N--CA 1.47 0.572 0 C-N-CA 124.805 1.242 . . . . 0.0 111.696 174.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.6 -10.0 14.59 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.488 2.792 . . . . 0.0 112.55 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 t -71.13 -17.3 62.57 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.057 1.343 . . . . 0.0 114.157 -173.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.62 163.7 33.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.489 1.516 . . . . 0.0 111.611 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.0 t-105 -58.32 112.4 1.55 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.844 1.257 . . . . 0.0 111.911 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.1 tpt85 -157.04 143.18 17.96 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.699 1.599 . . . . 0.0 109.992 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -136.52 153.63 50.96 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.553 1.141 . . . . 0.0 112.81 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.4 t -150.3 140.33 13.86 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 128.079 2.552 . . . . 0.0 108.366 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.425 ' C ' ' H ' ' A' ' 65' ' ' GLN . 86.5 Cg_exo -51.46 145.32 29.1 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.474 2.116 . . . . 0.0 111.787 168.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.4 tp -66.44 12.7 0.06 Allowed 'General case' 0 CA--C 1.554 1.134 0 O-C-N 120.576 -1.328 . . . . 0.0 114.185 176.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.425 ' H ' ' C ' ' A' ' 63' ' ' PRO . 58.4 mt-30 -64.93 -7.77 12.9 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.998 -1.688 . . . . 0.0 113.576 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -57.46 -25.78 60.23 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.031 1.333 . . . . 0.0 112.122 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -137.21 -42.19 0.57 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.607 1.163 . . . . 0.0 112.964 170.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.35 48.3 1.01 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.014 1.325 . . . . 0.0 111.492 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.31 -34.66 10.88 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.707 1.603 . . . . 0.0 115.099 -169.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -123.92 13.5 9.16 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.743 2.017 . . . . 0.0 113.286 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -133.39 -5.16 2.97 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.242 1.417 . . . . 0.0 113.942 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.0 t -54.88 -34.29 62.83 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.263 1.025 . . . . 0.0 112.819 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -118.91 140.21 50.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.62 1.568 . . . . 0.0 112.506 178.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 23.83 -115.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 127.429 2.292 . . . . 0.0 114.152 -169.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.0 t70 54.41 29.92 11.84 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.351 1.46 . . . . 0.0 113.718 -169.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -115.85 -21.25 9.66 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.972 1.709 . . . . 0.0 113.21 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -141.6 170.65 15.33 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.952 1.301 . . . . 0.0 113.537 -175.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -143.0 8.24 1.65 Allowed 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 169.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.36 9.41 1.08 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 125.053 1.341 . . . . 0.0 114.213 -175.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.96 160.86 23.96 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.414 -1.429 . . . . 0.0 112.097 -169.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.6 m -128.78 134.47 48.4 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 126.759 2.024 . . . . 0.0 108.825 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -104.61 146.98 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 124.292 1.037 . . . . 0.0 110.226 -173.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -138.18 160.9 38.21 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.663 1.985 . . . . 0.0 109.81 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.97 160.84 28.93 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.664 1.186 . . . . 0.0 112.424 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -148.0 130.58 7.8 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.948 2.099 . . . . 0.0 108.284 176.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -79.0 -5.21 37.48 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 CA-C-N 121.671 1.633 . . . . 0.0 113.146 -10.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -65.99 -178.83 0.65 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.177 1.791 . . . . 0.0 112.724 176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.6 138.87 25.44 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 124.485 1.114 . . . . 0.0 112.897 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.72 99.88 1.2 Allowed 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.72 2.947 . . . . 0.0 109.704 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -156.46 154.39 30.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.663 1.185 . . . . 0.0 111.67 -169.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -76.06 53.08 0.76 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.925 1.69 . . . . 0.0 113.51 -171.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 84.0 p -67.38 -12.85 61.25 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.426 1.49 . . . . 0.0 114.119 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.9 25.81 14.98 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.406 1.883 . . . . 0.0 113.2 -175.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -144.18 164.42 29.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 125.419 1.488 . . . . 0.0 110.299 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -64.84 141.22 70.57 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 CA-C-N 120.057 1.056 . . . . 0.0 111.951 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -89.21 -25.83 21.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.931 0.892 . . . . 0.0 110.96 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.5 t -123.98 134.91 65.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.691 1.996 . . . . 0.0 108.324 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.3 t -132.82 145.48 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.972 0.909 . . . . 0.0 111.36 -171.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.0 120.13 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.377 2.671 . . . . 0.0 108.422 -169.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.2 mt -85.54 164.21 17.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.253 1.025 . . . . 0.0 112.058 177.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.02 -13.79 13.22 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -175.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -120.32 9.79 11.1 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.48 1.512 . . . . 0.0 113.354 -177.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.96 9.02 58.71 Favored Glycine 0 CA--C 1.533 1.212 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 174.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.13 136.49 41.09 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.815 1.307 . . . . 0.0 108.438 169.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.21 142.59 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.915 1.286 . . . . 0.0 109.169 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.6 p -54.02 127.31 54.04 Favored Pre-proline 0 N--CA 1.472 0.655 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.232 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.34 122.78 8.98 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.535 2.157 . . . . 0.0 111.423 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.514 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 3.3 p90 -159.03 -179.27 7.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.925 2.09 . . . . 0.0 110.594 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -140.85 99.39 3.6 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 172.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.4 tp -57.73 127.93 34.53 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.369 2.268 . . . . 0.0 109.418 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -125.58 150.53 47.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.059 1.344 . . . . 0.0 110.546 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.3 mtt -133.06 144.74 50.21 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.42 -176.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.61 147.62 43.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.32 1.448 . . . . 0.0 111.317 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -65.86 121.43 15.03 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.982 0.913 . . . . 0.0 110.506 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.62 -18.91 64.41 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 176.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -72.07 -65.51 2.35 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.611 1.1 . . . . 0.0 113.166 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 38.5 p -83.83 -26.1 29.8 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 83.87 -0.1 89.59 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.142 1.353 . . . . 0.0 113.874 -170.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -80.09 145.91 61.91 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-N 118.705 1.253 . . . . 0.0 112.403 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.39 151.24 80.63 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.932 2.421 . . . . 0.0 112.007 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.61 -47.47 1.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.827 1.651 . . . . 0.0 112.619 -169.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.416 HD22 HE21 ' A' ' 134' ' ' GLN . 8.0 tp -151.94 156.2 39.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.951 1.3 . . . . 0.0 109.813 -169.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -146.69 139.31 25.11 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.384 1.074 . . . . 0.0 109.149 174.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.0 131.65 56.88 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.134 1.774 . . . . 0.0 108.285 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.9 t -118.95 139.83 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.456 1.502 . . . . 0.0 111.214 -169.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.7 t -123.21 144.59 49.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.031 1.732 . . . . 0.0 111.255 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.0 m -129.42 8.77 5.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.724 1.21 . . . . 0.0 113.712 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.89 -12.8 4.47 Favored Glycine 0 CA--C 1.537 1.424 0 N-CA-C 115.71 1.044 . . . . 0.0 115.71 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 87.7 p -157.78 159.71 37.05 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.057 1.428 . . . . 0.0 114.128 -173.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 35.0 t-105 -60.67 139.9 92.93 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 127.068 2.147 . . . . 0.0 115.803 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -95.9 179.01 8.47 Favored 'Cis proline' 0 CA--C 1.547 1.168 0 CA-C-N 120.05 1.053 . . . . 0.0 110.828 -11.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -72.3 165.35 24.65 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.15 -0.969 . . . . 0.0 112.251 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -118.71 129.49 55.31 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.891 1.676 . . . . 0.0 111.58 -176.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.416 HE21 HD22 ' A' ' 122' ' ' LEU . 51.7 tt0 -92.61 143.96 25.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.375 1.87 . . . . 0.0 112.582 -169.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.3 t -150.39 159.34 44.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.195 1.798 . . . . 0.0 110.924 171.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -78.85 134.45 36.94 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.366 -0.834 . . . . 0.0 109.014 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.18 60.13 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.939 2.096 . . . . 0.0 115.589 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 39.4 ptt180 44.68 27.29 0.24 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.874 2.87 . . . . 0.0 117.405 -176.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -57.94 -30.42 65.95 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 40.7 p -79.87 -15.24 57.75 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 174.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -72.01 -39.3 6.65 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo . . . . . 0 C--O 1.25 1.103 0 C-N-CA 124.297 3.331 . . . . 0.0 115.222 176.047 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.1 tpp . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 120.296 0.093 . . . . 0.0 110.79 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -131.09 18.66 4.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.138 1.375 . . . . 0.0 113.741 -173.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -137.0 155.05 50.2 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.583 1.553 . . . . 0.0 111.827 -175.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.96 44.04 0.22 Allowed Glycine 0 CA--C 1.535 1.317 0 C-N-CA 124.343 0.973 . . . . 0.0 113.495 -172.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 28.0 ttp-105 -129.46 22.82 5.52 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.272 1.829 . . . . 0.0 112.102 -172.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -60.83 -20.85 62.45 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.448 1.499 . . . . 0.0 114.861 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -66.11 -41.9 89.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.044 0.937 . . . . 0.0 112.432 171.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.02 -46.83 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 118.381 -0.819 . . . . 0.0 109.409 170.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.91 90.71 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.559 1.072 . . . . 0.0 113.028 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -61.82 -48.72 79.33 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.436 1.016 . . . . 0.0 111.818 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 m -57.66 -47.62 81.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.905 0.482 . . . . 0.0 111.12 176.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.72 -34.25 77.42 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.109 1.764 . . . . 0.0 112.424 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.82 -46.51 89.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.62 1.1 . . . . 0.0 111.534 169.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.61 -37.47 86.71 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.248 1.019 . . . . 0.0 111.663 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -65.44 -46.57 79.37 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.056 0.942 . . . . 0.0 112.238 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 84.8 m -60.34 -35.06 74.78 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.326 1.05 . . . . 0.0 111.803 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.55 73.4 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.025 1.33 . . . . 0.0 113.48 174.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -44.05 97.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.6 -0.687 . . . . 0.0 111.518 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -59.79 -48.54 81.28 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.6 1.16 . . . . 0.0 111.854 173.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -58.39 -44.6 89.0 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.134 0.879 . . . . 0.0 112.183 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 29.8 m -61.25 -43.03 99.55 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.493 0.588 . . . . 0.0 110.797 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.45 93.67 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.073 -1.017 . . . . 0.0 113.429 172.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.62 76.33 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.123 0.969 . . . . 0.0 112.779 175.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.3 tp -72.94 -34.64 66.69 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.756 1.223 . . . . 0.0 111.537 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.33 -45.33 93.72 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.049 -1.032 . . . . 0.0 110.833 169.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.33 -45.78 55.13 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.869 1.668 . . . . 0.0 111.178 169.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.51 96.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.91 -48.67 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.836 0.744 . . . . 0.0 110.427 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.25 -29.15 69.66 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.572 1.149 . . . . 0.0 113.167 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -87.01 -37.53 17.41 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.068 0.947 . . . . 0.0 113.082 177.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.22 -33.23 71.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.306 1.042 . . . . 0.0 113.623 -177.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 t -74.17 -13.87 60.87 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.6 mt -110.26 -35.96 5.94 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 113.536 -173.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.3 p -70.24 -35.24 73.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.908 1.283 . . . . 0.0 113.703 -177.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.26 0.8 50.84 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.406 1.479 . . . . 0.0 114.699 -175.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -144.67 147.6 36.48 Favored Pre-proline 0 N--CA 1.473 0.68 0 C-N-CA 125.243 1.417 . . . . 0.0 110.08 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -46.78 152.71 1.57 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 122.608 2.205 . . . . 0.0 112.116 167.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.23 160.65 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.417 1.487 . . . . 0.0 108.455 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.66 175.97 28.57 Favored Glycine 0 CA--C 1.522 0.482 0 O-C-N 120.886 -1.134 . . . . 0.0 114.53 -176.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.4 mt -135.72 127.65 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.603 1.161 . . . . 0.0 108.728 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -99.95 130.66 46.15 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.272 1.829 . . . . 0.0 109.587 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -118.61 121.71 40.85 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.055 1.742 . . . . 0.0 107.919 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 p -115.34 -178.47 3.38 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.567 1.147 . . . . 0.0 113.112 -169.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -65.54 -13.54 59.15 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.2 m -139.1 -21.34 0.95 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -170.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -156.65 -172.71 4.17 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.844 1.258 . . . . 0.0 111.495 -178.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p90 -147.64 149.21 32.07 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.3 -0.875 . . . . 0.0 110.28 169.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 67.1 mtt-85 -146.86 145.63 29.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.289 1.435 . . . . 0.0 111.9 -171.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 14.3 mm -73.57 146.65 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.0 mtp -135.86 146.23 47.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.355 1.062 . . . . 0.0 111.483 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.9 m -140.14 165.49 30.21 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.703 1.601 . . . . 0.0 112.358 -169.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -59.79 -31.56 94.17 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.272 2.648 . . . . 0.0 114.642 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 45.33 -83.53 0.01 OUTLIER Glycine 0 CA--C 1.536 1.393 0 C-N-CA 127.719 2.58 . . . . 0.0 116.082 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -62.33 -39.56 93.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.955 1.302 . . . . 0.0 113.196 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.1 t -161.32 136.7 5.7 Favored Pre-proline 0 N--CA 1.478 0.93 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.45 -12.35 3.86 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.75 2.966 . . . . 0.0 112.995 169.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 m -70.21 -16.19 63.03 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -169.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -149.75 165.18 33.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.736 2.014 . . . . 0.0 109.556 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.6 t-105 -49.95 115.64 1.48 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.748 1.219 . . . . 0.0 112.002 178.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -150.55 149.89 30.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.263 1.425 . . . . 0.0 110.404 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -142.18 137.9 31.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.727 0.811 . . . . 0.0 112.72 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.3 t -141.91 135.23 14.3 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 126.964 2.106 . . . . 0.0 108.224 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.86 137.61 45.69 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.868 2.378 . . . . 0.0 111.644 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.1 tp -96.47 127.16 42.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.284 0.634 . . . . 0.0 111.375 -172.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -159.96 -24.25 0.07 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 169.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.22 -18.2 46.84 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -172.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -126.78 16.61 7.45 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.634 1.574 . . . . 0.0 113.097 174.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -129.46 4.08 5.11 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.237 1.815 . . . . 0.0 113.225 176.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.55 -65.19 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 130.389 3.475 . . . . 0.0 116.552 -177.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -152.99 4.89 0.35 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.298 1.839 . . . . 0.0 113.106 -176.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.81 36.37 0.21 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.016 1.726 . . . . 0.0 113.38 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.8 t -140.35 -157.1 0.74 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.049 2.54 . . . . 0.0 108.839 -173.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 43.78 43.81 5.24 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 171.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 56.78 21.81 6.35 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -176.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.09 -16.35 51.66 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 118.931 -2.356 . . . . 0.0 113.918 172.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.5 m0 -66.05 -18.82 65.59 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -170.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -140.44 170.7 15.31 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -172.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.77 15.7 2.32 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.485 1.514 . . . . 0.0 113.392 175.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -146.27 -0.91 0.75 Allowed 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 115.274 1.583 . . . . 0.0 115.274 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 27.9 mt -120.58 162.63 19.31 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -168.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.6 t -139.13 131.24 28.03 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 128.442 2.697 . . . . 0.0 106.359 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -106.97 147.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 123.644 0.778 . . . . 0.0 111.183 -169.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -133.38 156.69 47.21 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.513 1.925 . . . . 0.0 109.549 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.12 162.88 31.7 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.06 0.944 . . . . 0.0 111.909 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.52 142.09 11.03 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.897 1.679 . . . . 0.0 110.002 169.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -72.59 -7.76 16.29 Favored 'Cis proline' 0 CA--C 1.546 1.083 0 CA-C-N 120.737 1.299 . . . . 0.0 113.32 -9.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -65.18 175.29 1.68 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.229 1.412 . . . . 0.0 112.073 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.58 142.28 19.0 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.254 1.022 . . . . 0.0 113.027 -174.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.33 91.71 1.11 Allowed 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 124.1 3.2 . . . . 0.0 110.826 177.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -157.38 138.45 13.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 0.0 110.272 -170.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -60.89 86.76 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.408 1.083 . . . . 0.0 112.006 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.7 m -95.69 -2.16 48.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.782 1.633 . . . . 0.0 113.161 -169.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.43 18.39 3.45 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 126.877 2.071 . . . . 0.0 114.449 -177.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -158.43 162.43 26.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 126.876 2.07 . . . . 0.0 109.348 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.28 152.4 75.82 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 CA-C-N 120.178 1.099 . . . . 0.0 110.441 169.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -102.85 -44.58 5.23 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.479 0.312 . . . . 0.0 110.289 170.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.0 t -74.85 132.8 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.864 0.866 . . . . 0.0 109.183 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.2 t -134.37 144.81 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.814 0.846 . . . . 0.0 110.796 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.4 mp -130.45 122.31 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 127.749 2.42 . . . . 0.0 109.46 -169.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.2 mt -87.92 159.75 18.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.997 0.904 . . . . 0.0 111.623 174.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.05 -27.57 63.71 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.127 1.371 . . . . 0.0 114.509 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -84.74 -5.18 59.31 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.088 1.355 . . . . 0.0 113.431 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.39 12.14 61.7 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.217 0.913 . . . . 0.0 114.61 -176.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -76.89 136.38 38.84 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 118.482 1.141 . . . . 0.0 108.734 169.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -130.01 148.32 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.054 1.341 . . . . 0.0 109.431 -172.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 p -51.49 124.06 24.01 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.047 0.939 . . . . 0.0 111.908 169.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -74.03 92.69 0.89 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.151 2.567 . . . . 0.0 111.6 177.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -134.34 -178.09 4.89 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.258 1.823 . . . . 0.0 112.093 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 m -141.68 147.63 37.79 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.665 0.786 . . . . 0.0 111.259 169.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.5 133.01 52.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.993 2.117 . . . . 0.0 108.438 -176.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -122.14 147.19 46.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.119 -176.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 52.3 mtt -123.85 129.5 51.11 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.983 1.313 . . . . 0.0 109.761 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.9 143.6 51.23 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.896 1.678 . . . . 0.0 111.061 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -53.49 124.18 14.15 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.525 1.13 . . . . 0.0 111.566 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.54 -20.6 56.75 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -112.07 -48.62 0.65 Allowed Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.773 1.177 . . . . 0.0 113.214 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.8 m -71.87 -22.02 61.58 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.13 0.965 . . . . 0.0 112.288 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 68.14 35.86 84.26 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.235 0.921 . . . . 0.0 113.49 177.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -133.06 132.72 22.48 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.422 1.489 . . . . 0.0 110.887 -169.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -53.11 145.06 44.32 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 124.051 3.167 . . . . 0.0 115.0 177.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -34.08 4.09 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.736 1.215 . . . . 0.0 111.44 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -154.4 157.58 38.74 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 111.997 -168.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 7.4 m -143.94 147.8 34.46 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.301 1.84 . . . . 0.0 109.403 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.6 mp -119.42 142.17 48.45 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 126.161 1.785 . . . . 0.0 108.784 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 40.0 t -135.11 134.4 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.665 0.786 . . . . 0.0 111.702 -169.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -108.86 161.29 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.958 1.303 . . . . 0.0 112.137 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.5 p -133.78 2.07 3.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.885 1.674 . . . . 0.0 113.766 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 121.56 -8.82 10.1 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.121 1.343 . . . . 0.0 114.503 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.4 p -155.65 159.38 39.54 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 118.59 1.195 . . . . 0.0 113.75 -174.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.8 t-105 -60.9 138.73 93.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.852 2.061 . . . . 0.0 115.732 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.6 175.55 10.3 Favored 'Cis proline' 0 CA--C 1.546 1.11 0 CA-C-N 119.926 1.009 . . . . 0.0 110.717 -11.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.0 154.31 42.11 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 122.203 1.001 . . . . 0.0 110.718 169.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -79.05 168.11 20.12 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.311 1.445 . . . . 0.0 109.047 169.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -144.42 130.63 19.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.546 1.538 . . . . 0.0 109.968 -177.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.3 t -151.83 160.83 43.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.956 1.302 . . . . 0.0 112.173 -171.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.33 131.09 35.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.412 -0.805 . . . . 0.0 109.142 169.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.27 61.08 0.55 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.203 1.801 . . . . 0.0 115.541 173.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 57.29 12.37 1.37 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.997 2.519 . . . . 0.0 117.291 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -55.63 -35.05 65.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.575 2.065 . . . . 0.0 116.575 -169.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -80.59 -15.64 56.13 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -66.65 133.93 94.23 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.075 0.95 . . . . 0.0 112.182 -169.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 C--O 1.249 1.062 0 C-N-CA 123.446 2.764 . . . . 0.0 113.17 178.334 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.76 146.1 32.88 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.431 1.092 . . . . 0.0 111.063 171.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -68.88 -18.75 64.18 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -150.74 155.2 26.04 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 126.524 2.012 . . . . 0.0 109.974 170.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 66.5 mtt85 -71.22 81.11 0.72 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.624 1.57 . . . . 0.0 113.013 -169.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -52.57 -34.28 49.7 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -173.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -72.82 -38.36 67.18 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.985 -1.072 . . . . 0.0 113.033 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.83 -38.9 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.94 170.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.73 -44.03 97.27 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.317 0.962 . . . . 0.0 112.422 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -57.75 -46.33 84.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.085 1.311 . . . . 0.0 111.843 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.8 m -61.41 -57.11 13.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.615 0.766 . . . . 0.0 111.255 178.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -63.11 -34.39 77.51 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.145 1.378 . . . . 0.0 113.076 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.65 -52.76 63.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.692 1.587 . . . . 0.0 111.719 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -64.22 -41.87 96.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.93 -54.25 44.49 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.307 1.443 . . . . 0.0 112.417 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.3 m -60.6 -36.43 78.55 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.892 1.277 . . . . 0.0 111.414 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.91 86.9 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.5 99.29 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.433 -0.792 . . . . 0.0 111.915 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -61.39 -46.32 90.67 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 111.858 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -62.73 -41.42 99.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.473 0.709 . . . . 0.0 112.107 173.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.1 m -59.38 -41.55 89.59 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.1 0.863 . . . . 0.0 111.322 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -40.65 96.05 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.77 -1.206 . . . . 0.0 113.399 172.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.68 -30.98 71.75 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 121.144 -0.972 . . . . 0.0 113.234 174.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.0 tp -72.1 -34.52 68.7 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.39 1.076 . . . . 0.0 111.84 172.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.18 -46.11 90.39 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.058 -1.026 . . . . 0.0 111.467 169.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.9 tp -53.98 -46.83 71.81 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.082 1.353 . . . . 0.0 111.982 170.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.45 -43.67 88.92 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 175.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.33 -46.62 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.805 0.842 . . . . 0.0 110.981 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -31.28 69.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.924 0.89 . . . . 0.0 112.931 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.9 mtt-85 -80.28 -37.98 31.73 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.24 1.016 . . . . 0.0 113.483 172.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.93 -34.47 78.18 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.524 1.056 . . . . 0.0 113.369 -175.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.1 t -70.29 -20.18 63.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.94 -31.25 9.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.199 1.4 . . . . 0.0 114.336 -174.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.7 m -82.13 -14.19 56.09 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.81 -3.94 81.51 Favored Glycine 0 CA--C 1.54 1.632 0 C-N-CA 124.22 0.914 . . . . 0.0 115.069 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -139.99 151.84 66.21 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 128.399 2.68 . . . . 0.0 106.765 170.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -45.63 166.65 0.06 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.358 3.372 . . . . 0.0 115.871 169.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -123.22 161.22 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 126.283 1.833 . . . . 0.0 108.235 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -165.28 -175.56 36.04 Favored Glycine 0 N--CA 1.469 0.889 0 CA-C-N 120.698 1.59 . . . . 0.0 115.964 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -127.41 122.54 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.783 1.233 . . . . 0.0 110.886 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -83.4 68.88 9.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.346 1.858 . . . . 0.0 111.322 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -59.65 119.95 8.56 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.466 -0.771 . . . . 0.0 110.219 169.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 84.1 p -141.33 13.52 2.18 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -169.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.76 -47.28 0.26 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.693 2.797 . . . . 0.0 115.169 -174.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.7 m -69.27 -26.95 65.01 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.63 1.172 . . . . 0.0 112.611 171.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.47 166.63 31.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.425 1.89 . . . . 0.0 111.043 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -155.96 99.39 1.97 Allowed 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.915 -0.491 . . . . 0.0 111.558 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -142.42 161.69 37.39 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -169.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.1 mm -71.47 142.52 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.528 1.131 . . . . 0.0 111.213 -171.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 81.0 mtp -128.4 146.67 50.72 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.796 1.638 . . . . 0.0 110.17 169.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 m -133.7 158.86 74.52 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 125.922 1.689 . . . . 0.0 111.26 -170.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -52.39 144.84 38.66 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.417 2.745 . . . . 0.0 115.503 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -101.62 -151.24 24.31 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 125.513 1.53 . . . . 0.0 113.087 175.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -55.42 -23.7 26.36 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.2 p -133.27 65.5 72.93 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 119.44 1.018 . . . . 0.0 113.204 -169.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -63.09 -17.19 58.93 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 123.04 2.493 . . . . 0.0 113.272 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -59.59 -15.36 18.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.427 1.491 . . . . 0.0 114.008 169.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.85 -87.39 0.2 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.62 1.168 . . . . 0.0 111.947 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -162.88 110.08 1.23 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.435 1.094 . . . . 0.0 111.874 -171.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.58 151.29 29.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.211 1.004 . . . . 0.0 110.11 169.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -138.69 150.5 46.26 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -171.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.8 t -143.4 138.96 15.96 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 126.957 2.103 . . . . 0.0 108.686 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.93 145.82 90.63 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.592 2.194 . . . . 0.0 111.304 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.42 45.46 0.23 Allowed 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -170.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -58.01 -20.76 41.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 119.635 -1.915 . . . . 0.0 113.841 172.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -59.42 -18.84 42.56 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.245 1.018 . . . . 0.0 113.686 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -130.69 -35.27 1.47 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.2 1.0 . . . . 0.0 113.498 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.13 -8.19 59.29 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 177.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.14 -60.29 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 129.436 3.095 . . . . 0.0 116.158 -173.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -148.03 -0.55 0.6 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.431 1.892 . . . . 0.0 112.898 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -92.23 0.49 57.46 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.674 -1.266 . . . . 0.0 113.415 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.2 p -64.57 13.89 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 128.456 2.702 . . . . 0.0 117.28 -172.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -154.44 42.82 0.51 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.557 1.543 . . . . 0.0 111.717 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -136.59 163.2 31.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.562 1.545 . . . . 0.0 112.878 -173.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -72.7 -177.42 2.3 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.782 0.833 . . . . 0.0 110.78 168.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -120.45 -6.83 9.77 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -150.64 -168.66 3.17 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -168.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -125.22 2.67 7.85 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.458 1.903 . . . . 0.0 114.382 -175.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -150.12 -4.33 0.36 Allowed 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -169.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.4 mt -105.84 167.91 9.47 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.707 -1.246 . . . . 0.0 113.139 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.7 t -140.76 136.59 32.68 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.427 2.291 . . . . 0.0 107.83 169.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.72 145.36 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.47 1.108 . . . . 0.0 111.272 -169.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -137.76 157.56 46.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.239 1.816 . . . . 0.0 110.142 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 tt -151.22 146.01 25.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.9 0.88 . . . . 0.0 112.089 -171.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -151.69 150.88 27.44 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.579 1.552 . . . . 0.0 111.125 169.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -80.04 -13.12 35.62 Favored 'Cis proline' 0 CA--C 1.543 0.943 0 CA-C-N 120.198 1.107 . . . . 0.0 114.451 -0.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -64.19 144.23 57.29 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.948 0.88 . . . . 0.0 113.234 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -62.49 128.87 92.08 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.539 1.536 . . . . 0.0 112.008 170.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.59 57.58 6.15 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 123.768 2.979 . . . . 0.0 109.673 169.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.39 150.0 26.45 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.039 1.336 . . . . 0.0 113.369 -169.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -74.17 47.98 0.3 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.859 1.664 . . . . 0.0 112.579 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.1 m -67.96 -5.59 17.9 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.942 1.697 . . . . 0.0 115.383 -172.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 56.31 27.83 12.47 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 126.157 1.783 . . . . 0.0 113.516 -174.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -146.9 163.12 30.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 109.3 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.75 147.54 85.79 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 CA-C-N 120.085 1.066 . . . . 0.0 111.867 169.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -95.3 -50.47 5.01 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.686 1.194 . . . . 0.0 109.806 170.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 68.3 t -89.66 136.4 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.371 1.468 . . . . 0.0 108.15 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 48.8 t -135.16 143.57 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-O 122.147 0.975 . . . . 0.0 111.947 -171.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -117.19 111.03 33.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 128.582 2.753 . . . . 0.0 107.639 -176.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.15 153.07 36.48 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.134 0.973 . . . . 0.0 109.81 177.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.82 -21.93 44.94 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.28 -11.4 59.9 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.275 1.43 . . . . 0.0 113.573 176.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.48 42.67 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.499 1.047 . . . . 0.0 114.187 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.69 147.44 29.58 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.981 1.312 . . . . 0.0 108.103 173.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -121.97 150.88 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.693 0.797 . . . . 0.0 110.585 -168.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.3 p -56.78 130.52 78.18 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.693 169.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -74.97 134.08 17.42 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.34 2.027 . . . . 0.0 112.201 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.433 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 14.5 p90 -163.92 177.28 8.68 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.693 1.997 . . . . 0.0 111.346 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.4 p -138.54 148.49 44.31 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.015 0.912 . . . . 0.0 110.646 169.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 tp -135.81 130.19 33.6 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.835 2.054 . . . . 0.0 108.089 -169.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -121.2 150.25 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.007 1.323 . . . . 0.0 110.363 -173.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 55.3 mtt -127.53 139.66 52.63 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 125.561 1.545 . . . . 0.0 108.669 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -136.83 151.39 49.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.293 1.437 . . . . 0.0 111.11 -177.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -61.73 119.8 9.41 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.365 1.066 . . . . 0.0 109.685 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.1 -19.4 61.42 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -174.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -101.66 -45.02 1.86 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 124.073 0.844 . . . . 0.0 113.609 -177.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.6 p -80.29 -27.82 38.42 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.707 1.254 . . . . 0.0 112.858 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 79.75 0.86 85.99 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 125.119 1.342 . . . . 0.0 113.928 -172.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -75.9 138.42 69.45 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 118.564 1.182 . . . . 0.0 111.638 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.25 154.59 72.86 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.566 2.177 . . . . 0.0 111.798 175.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.25 -51.32 1.19 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.983 1.713 . . . . 0.0 112.06 -169.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.82 153.12 40.55 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 126.847 2.059 . . . . 0.0 108.426 -169.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 4.9 m -143.97 136.84 27.28 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.539 0.736 . . . . 0.0 109.506 172.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.1 mp -116.55 143.78 45.18 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.819 2.448 . . . . 0.0 108.096 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 24.0 t -141.44 134.1 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.901 0.48 . . . . 0.0 111.911 -171.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.433 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.7 t -112.72 114.64 27.31 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.943 1.697 . . . . 0.0 110.305 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.4 p -75.34 -13.2 60.4 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.935 1.294 . . . . 0.0 114.296 174.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 128.21 0.62 6.36 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.414 1.483 . . . . 0.0 114.339 -175.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 19.5 m -156.56 156.06 32.97 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.428 -1.631 . . . . 0.0 112.996 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 30.3 t-105 -60.09 140.15 90.87 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 125.939 1.696 . . . . 0.0 115.344 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -94.29 176.55 12.33 Favored 'Cis proline' 0 CA--C 1.546 1.089 0 CA-C-N 119.932 1.011 . . . . 0.0 110.751 -11.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.1 mp -67.87 149.52 49.73 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.069 -1.019 . . . . 0.0 110.746 169.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -77.87 170.7 16.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.982 1.313 . . . . 0.0 110.282 170.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -140.01 144.45 36.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.781 1.632 . . . . 0.0 111.394 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.7 t -153.42 151.55 30.02 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.889 1.275 . . . . 0.0 111.7 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.88 134.22 50.48 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.588 -0.695 . . . . 0.0 109.841 170.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.68 67.87 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 127.423 2.289 . . . . 0.0 116.579 171.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.3 mtm105 55.7 19.65 3.51 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.27 -17.52 12.24 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -177.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 8.3 t -134.09 28.34 3.8 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.022 1.329 . . . . 0.0 113.334 169.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.66 71.23 71.03 Favored Pre-proline 0 N--CA 1.481 1.12 0 C-N-CA 125.282 1.433 . . . . 0.0 110.677 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo . . . . . 0 C--O 1.251 1.167 1 C-N-CA 125.507 4.138 . . . . 0.0 116.048 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.487 1.418 0 N-CA-C 110.669 -0.122 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.51 161.68 39.19 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.754 1.222 . . . . 0.0 112.091 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -61.57 -25.4 67.3 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.013 1.725 . . . . 0.0 114.687 -172.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -171.71 162.97 35.46 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.416 1.484 . . . . 0.0 111.89 174.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 52.59 19.07 1.11 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 126.005 1.722 . . . . 0.0 114.734 -175.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -56.36 -38.51 71.5 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -169.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.58 -40.13 80.66 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.107 0.867 . . . . 0.0 112.316 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.46 -46.4 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.253 0.621 . . . . 0.0 109.957 174.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.22 87.38 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.731 0.696 . . . . 0.0 112.37 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -63.63 -46.42 85.76 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.204 0.911 . . . . 0.0 112.219 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.6 m -56.72 -49.77 74.19 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.932 175.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -67.47 -28.57 67.97 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.001 -1.0 . . . . 0.0 113.615 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.52 -48.09 78.99 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 120.711 1.596 . . . . 0.0 111.37 171.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -67.74 -40.64 84.14 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.829 1.252 . . . . 0.0 111.431 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.75 -38.65 80.28 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.697 0.799 . . . . 0.0 113.038 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.5 m -69.71 -34.44 73.9 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 120.117 -1.614 . . . . 0.0 111.853 175.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.65 91.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 170.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.29 92.94 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 112.06 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -64.49 -45.08 88.84 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.016 0.926 . . . . 0.0 112.328 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -62.76 -40.35 97.0 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.195 0.598 . . . . 0.0 112.342 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -60.86 -44.08 97.49 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.796 0.726 . . . . 0.0 110.795 175.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.75 98.29 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.686 -1.259 . . . . 0.0 113.391 172.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.49 76.15 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.14 -0.975 . . . . 0.0 113.097 175.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.1 tp -73.13 -31.74 64.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.439 1.095 . . . . 0.0 111.818 173.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -62.97 -44.31 96.39 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.935 -1.103 . . . . 0.0 110.864 169.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.15 -44.64 67.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.376 1.47 . . . . 0.0 111.321 169.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.28 97.15 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.2 mt -64.14 -45.0 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.202 1.001 . . . . 0.0 111.099 174.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.43 -43.52 75.44 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.803 0.841 . . . . 0.0 112.1 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.73 -31.77 61.92 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 178.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.8 89.7 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.414 1.007 . . . . 0.0 113.191 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -76.08 -24.26 55.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.12 -31.11 13.7 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -174.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.2 p -89.5 -14.52 35.07 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -169.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.23 6.53 78.27 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 170.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.62 151.71 54.51 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.987 2.115 . . . . 0.0 107.596 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -46.88 149.31 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 121.98 1.787 . . . . 0.0 111.652 167.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.19 164.93 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.323 1.849 . . . . 0.0 108.486 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.29 -178.68 30.68 Favored Glycine 0 C--N 1.332 0.308 0 O-C-N 120.762 -1.211 . . . . 0.0 115.404 -174.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.6 mt -135.6 120.88 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.564 1.146 . . . . 0.0 108.543 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -89.97 141.89 28.23 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 126.156 1.783 . . . . 0.0 110.861 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -140.07 130.23 25.06 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.137 1.775 . . . . 0.0 109.449 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 t -132.55 179.66 6.0 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.233 1.413 . . . . 0.0 111.039 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -61.85 -14.95 38.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -169.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 -8.42 0.92 Allowed 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 -178.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.5 164.52 36.08 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.778 1.172 . . . . 0.0 113.248 -177.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -149.67 156.22 41.52 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.269 1.828 . . . . 0.0 112.006 -175.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -161.26 148.0 14.73 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.727 1.611 . . . . 0.0 111.342 -175.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.9 mm -68.23 147.68 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 124.411 1.085 . . . . 0.0 109.566 172.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 44.7 mtp -135.75 150.67 49.58 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.474 -1.391 . . . . 0.0 112.466 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 9.4 m -144.06 168.03 13.67 Favored Pre-proline 0 N--CA 1.478 0.969 0 C-N-CA 126.219 1.808 . . . . 0.0 111.736 -169.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -57.53 -33.74 96.95 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.821 2.347 . . . . 0.0 114.089 171.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.46 -50.27 0.61 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 127.47 2.462 . . . . 0.0 116.673 170.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -137.72 -26.52 0.96 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.342 1.457 . . . . 0.0 114.578 -170.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.0 t -148.84 74.94 10.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 123.8 0.84 . . . . 0.0 112.646 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -63.35 -11.5 25.92 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.996 2.464 . . . . 0.0 113.624 170.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.2 m -60.08 -16.89 35.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.538 1.935 . . . . 0.0 114.662 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.01 171.01 15.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.133 1.773 . . . . 0.0 110.472 175.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.3 t-105 -62.8 112.39 2.52 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.366 -0.834 . . . . 0.0 111.145 173.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.434 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 4.6 tpm_? -150.65 157.29 42.8 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.852 1.261 . . . . 0.0 110.98 174.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.434 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 85.4 m95 -139.19 138.46 36.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.207 1.403 . . . . 0.0 111.945 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.77 138.86 17.57 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 126.966 2.106 . . . . 0.0 107.795 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.08 128.74 22.49 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.84 2.36 . . . . 0.0 111.183 175.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.3 tp -76.17 78.8 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.366 1.066 . . . . 0.0 111.133 -176.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -91.3 5.46 49.12 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.32 1.048 . . . . 0.0 112.24 171.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -50.11 110.54 0.41 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.728 2.011 . . . . 0.0 111.966 173.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.0 t70 57.95 -29.71 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.533 2.733 . . . . 0.0 116.385 -171.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.38 -18.29 64.43 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.346 1.859 . . . . 0.0 113.644 175.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.73 -178.01 0.14 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.329 2.652 . . . . 0.0 115.653 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -72.8 23.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.967 1.707 . . . . 0.0 114.619 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.31 7.18 5.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.896 2.078 . . . . 0.0 111.216 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 73.3 p -79.83 -23.53 41.96 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.357 1.463 . . . . 0.0 114.084 -177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -74.08 123.19 23.93 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.248 1.019 . . . . 0.0 109.207 169.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -147.43 -179.48 6.88 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.098 0.959 . . . . 0.0 112.801 -169.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.91 25.51 10.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.05 2.14 . . . . 0.0 112.579 -177.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER 58.17 -44.66 0.05 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 130.131 3.372 . . . . 0.0 118.413 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -156.55 -167.91 2.54 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.334 0.97 . . . . 0.0 113.409 -169.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -128.09 -14.14 4.97 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.785 2.034 . . . . 0.0 113.121 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -120.42 5.03 10.69 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.59 1.556 . . . . 0.0 111.904 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -139.26 141.63 37.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.531 1.532 . . . . 0.0 110.064 -169.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 88.9 p -137.14 154.91 50.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.678 1.991 . . . . 0.0 111.39 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.07 147.6 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.107 1.363 . . . . 0.0 112.173 -169.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -139.68 162.28 35.49 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.898 2.079 . . . . 0.0 110.838 170.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.2 mt -141.14 155.95 46.02 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.592 1.157 . . . . 0.0 113.932 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.69 155.14 22.18 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.893 2.077 . . . . 0.0 110.325 169.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.13 -9.16 18.38 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 CA-C-N 120.469 1.203 . . . . 0.0 113.207 -9.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.16 172.01 1.59 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.613 1.565 . . . . 0.0 113.361 173.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -126.31 121.66 23.81 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.368 1.867 . . . . 0.0 110.932 -170.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.5 98.3 0.94 Allowed 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.698 2.265 . . . . 0.0 110.475 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -154.35 157.23 38.27 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.483 1.513 . . . . 0.0 111.301 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -70.52 47.0 0.09 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 128.219 2.608 . . . . 0.0 114.358 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.6 t -65.05 160.96 19.8 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.101 2.16 . . . . 0.0 114.303 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -63.81 -13.79 47.4 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.628 1.571 . . . . 0.0 112.727 169.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -131.04 162.78 53.52 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.271 1.428 . . . . 0.0 112.571 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -70.81 164.56 35.13 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.179 2.586 . . . . 0.0 112.416 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -95.57 -21.94 17.94 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.619 1.568 . . . . 0.0 112.398 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.1 t -114.11 143.26 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.547 1.139 . . . . 0.0 108.875 169.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.2 t -136.18 137.75 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 110.326 -178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -125.25 117.97 51.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 128.679 2.791 . . . . 0.0 106.925 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.15 148.58 35.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.385 0.612 . . . . 0.0 110.224 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.9 -22.79 60.16 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -70.02 -22.82 63.07 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.08 1.752 . . . . 0.0 113.458 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 104.09 5.13 44.17 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.98 1.276 . . . . 0.0 115.056 -179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -90.55 154.53 19.54 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.81 1.644 . . . . 0.0 109.869 169.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 1.2 mp -129.76 142.7 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 124.696 1.198 . . . . 0.0 109.605 -169.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t -56.17 140.43 70.98 Favored Pre-proline 0 N--CA 1.477 0.875 0 C-N-CA 123.541 0.736 . . . . 0.0 112.642 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -64.73 131.18 28.45 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.765 2.31 . . . . 0.0 112.601 169.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -161.52 173.57 14.63 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.785 1.634 . . . . 0.0 111.364 170.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.3 t -134.28 135.55 42.94 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.07 0.948 . . . . 0.0 110.194 169.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.1 tp -128.64 116.0 18.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 128.06 2.544 . . . . 0.0 108.467 -169.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -105.35 147.06 28.58 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.752 1.221 . . . . 0.0 110.444 -173.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 51.1 mtt -128.38 130.56 47.86 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.849 1.66 . . . . 0.0 109.753 -176.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -134.26 152.29 51.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.773 1.229 . . . . 0.0 112.29 -169.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -64.93 110.4 2.43 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.116 1.367 . . . . 0.0 110.528 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.56 -15.83 59.12 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.69 -20.49 59.75 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.721 1.153 . . . . 0.0 114.384 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -132.03 -21.28 2.4 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.987 1.393 . . . . 0.0 114.424 -171.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 86.78 -1.09 86.88 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 125.599 1.571 . . . . 0.0 114.4 -176.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -83.97 131.51 51.2 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.583 1.191 . . . . 0.0 112.517 -171.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 143.47 40.48 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.531 2.821 . . . . 0.0 113.568 169.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.11 -44.66 1.15 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.686 1.594 . . . . 0.0 112.151 -172.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 tt -149.94 155.21 39.58 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.833 1.653 . . . . 0.0 108.172 -178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 85.5 m -144.04 151.11 39.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.233 -1.542 . . . . 0.0 109.505 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 78.1 mt -128.11 133.59 49.03 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 127.295 2.238 . . . . 0.0 108.323 -169.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.5 t -133.58 135.92 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 122.982 0.513 . . . . 0.0 111.995 -169.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 34.0 t -119.41 141.0 49.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.945 1.698 . . . . 0.0 110.443 175.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -127.94 2.28 5.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.193 1.397 . . . . 0.0 113.833 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 152.59 -20.14 0.8 Allowed Glycine 0 CA--C 1.535 1.317 0 N-CA-C 115.852 1.101 . . . . 0.0 115.852 175.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 4.9 t -156.26 165.27 36.87 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.771 1.785 . . . . 0.0 114.345 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 -63.86 143.66 98.1 Favored Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 127.738 2.415 . . . . 0.0 115.333 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -91.44 177.26 15.84 Favored 'Cis proline' 0 CA--C 1.546 1.102 0 CA-C-N 119.479 0.85 . . . . 0.0 110.472 -11.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.3 156.26 38.07 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.061 -1.024 . . . . 0.0 111.66 169.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -101.98 129.02 48.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.445 1.498 . . . . 0.0 110.858 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -84.58 149.62 25.76 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.844 1.258 . . . . 0.0 112.048 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.0 t -149.77 146.17 27.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.028 1.731 . . . . 0.0 109.623 169.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.28 136.49 42.64 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.097 -1.002 . . . . 0.0 109.814 170.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 61.07 0.11 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.365 2.266 . . . . 0.0 115.427 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 11.6 ptm180 44.7 27.95 0.3 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.128 2.571 . . . . 0.0 117.763 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.76 -34.57 65.33 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.14 -4.1 58.56 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 174.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.37 48.67 0.51 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.25 1.42 . . . . 0.0 114.612 -170.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo . . . . . 0 C--O 1.249 1.058 0 C-N-CA 123.501 2.8 . . . . 0.0 113.173 179.555 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 ttp . . . . . 0 N--CA 1.489 1.485 0 N-CA-C 110.456 -0.202 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.3 170.69 17.94 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.085 1.354 . . . . 0.0 111.775 179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -127.89 5.79 6.02 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.125 1.77 . . . . 0.0 112.537 -175.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -148.15 157.19 27.24 Favored Glycine 0 CA--C 1.531 1.082 0 C-N-CA 127.785 2.612 . . . . 0.0 108.625 169.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -69.8 86.54 0.5 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.323 1.049 . . . . 0.0 113.701 -169.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -54.05 -26.19 25.4 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 171.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -76.92 -3.72 40.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.035 1.334 . . . . 0.0 114.425 175.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.3 t -129.54 -35.67 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 126.021 1.729 . . . . 0.0 111.696 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.64 73.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.719 1.208 . . . . 0.0 113.563 -173.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -60.01 -52.31 65.92 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.591 1.087 . . . . 0.0 111.919 174.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.9 m -60.08 -44.45 94.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.985 0.914 . . . . 0.0 111.386 177.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -33.92 76.11 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.268 1.027 . . . . 0.0 112.866 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.07 -48.78 78.7 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.872 1.215 . . . . 0.0 111.302 170.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -62.47 -38.34 89.47 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.523 1.129 . . . . 0.0 111.913 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.22 -50.34 68.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.09 1.356 . . . . 0.0 111.932 170.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.8 m -62.52 -32.94 73.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.549 1.14 . . . . 0.0 111.389 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.8 80.22 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.596 1.158 . . . . 0.0 113.292 170.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.3 95.29 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.462 -0.774 . . . . 0.0 111.736 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.99 -47.37 86.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.111 1.364 . . . . 0.0 112.058 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.59 -42.2 98.52 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.698 0.799 . . . . 0.0 112.458 171.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 59.6 m -59.29 -40.79 87.26 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.558 -0.714 . . . . 0.0 111.283 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.99 92.52 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.808 -1.183 . . . . 0.0 113.374 172.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.19 -33.73 76.45 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.202 -0.936 . . . . 0.0 112.915 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -70.37 -35.26 73.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.554 1.142 . . . . 0.0 112.147 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.62 -44.32 96.58 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.076 -1.015 . . . . 0.0 111.723 170.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.2 tp -54.11 -46.48 72.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.148 1.379 . . . . 0.0 111.534 170.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.02 96.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.3 mt -62.51 -46.53 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.261 0.937 . . . . 0.0 110.806 173.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.38 -36.59 78.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.463 0.705 . . . . 0.0 112.599 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -73.69 -30.67 63.02 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.04 0.936 . . . . 0.0 113.14 174.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.05 -39.77 90.41 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.971 1.259 . . . . 0.0 114.083 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -68.23 -29.04 67.77 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.675 -0.641 . . . . 0.0 112.121 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.1 mt -79.87 -33.77 39.75 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.025 1.33 . . . . 0.0 113.055 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.8 m -75.39 -22.57 57.36 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -173.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.89 9.79 71.37 Favored Glycine 0 CA--C 1.541 1.706 0 C-N-CA 123.74 0.686 . . . . 0.0 114.434 -176.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -151.15 150.64 27.79 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 128.402 2.681 . . . . 0.0 107.592 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -47.66 149.95 4.5 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.508 2.139 . . . . 0.0 112.741 168.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -116.17 165.31 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 126.913 2.085 . . . . 0.0 108.714 -175.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -150.59 175.42 29.62 Favored Glycine 0 CA--C 1.52 0.371 0 O-C-N 121.024 -1.047 . . . . 0.0 115.508 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.6 mt -132.67 120.1 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 124.858 1.263 . . . . 0.0 108.316 178.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -81.86 146.03 30.06 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.306 1.442 . . . . 0.0 110.771 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -142.35 138.3 31.13 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.461 1.905 . . . . 0.0 110.587 174.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.8 p -129.6 -177.61 4.34 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.661 1.584 . . . . 0.0 112.09 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.09 -15.6 14.87 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.1 p -142.61 -11.06 0.81 Allowed 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.466 2.025 . . . . 0.0 116.466 -172.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -150.73 172.13 16.06 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.117 1.326 . . . . 0.0 113.816 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -141.72 158.61 43.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.136 1.774 . . . . 0.0 110.849 171.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -158.51 161.92 37.41 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 124.064 0.945 . . . . 0.0 112.916 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.7 mm -80.08 145.05 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.563 1.145 . . . . 0.0 108.849 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 70.2 mtp -135.81 143.38 45.14 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.209 1.003 . . . . 0.0 111.636 175.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.45 166.25 20.92 Favored Pre-proline 0 N--CA 1.483 1.192 0 C-N-CA 126.223 1.809 . . . . 0.0 111.177 -169.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.63 163.4 24.49 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.725 2.284 . . . . 0.0 113.285 171.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.41 -84.37 0.09 OUTLIER Glycine 0 N--CA 1.472 1.059 0 C-N-CA 123.86 0.743 . . . . 0.0 114.292 176.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 10.8 mmpt? -61.41 -31.31 71.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.712 0.805 . . . . 0.0 113.013 -176.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.7 t -158.0 140.67 10.6 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 124.456 1.103 . . . . 0.0 111.37 169.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -81.93 5.17 6.49 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 124.055 3.17 . . . . 0.0 112.52 169.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.2 m -62.56 -27.9 69.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -171.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -159.58 -49.74 0.05 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -148.23 -74.93 0.18 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -169.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -8.64 83.02 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 129.261 3.024 . . . . 0.0 116.454 -169.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -66.3 161.02 23.27 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.486 1.514 . . . . 0.0 114.693 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 41.4 t -140.36 142.34 29.16 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 128.262 2.625 . . . . 0.0 107.626 174.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.6 43.15 0.63 Allowed 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.854 3.702 . . . . 0.0 113.172 173.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.6 tp 52.92 -90.01 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.395 2.678 . . . . 0.0 112.665 -169.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 51.31 12.96 0.16 Allowed 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -66.61 -23.39 66.17 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.64 -1.287 . . . . 0.0 113.394 173.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -141.02 -38.96 0.41 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.753 1.621 . . . . 0.0 111.411 172.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 40.06 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.337 1.855 . . . . 0.0 112.579 169.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.88 -25.04 0.26 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 128.982 2.913 . . . . 0.0 118.787 -168.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -140.48 18.5 2.38 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.923 1.289 . . . . 0.0 111.76 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -146.03 18.38 1.42 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.756 1.223 . . . . 0.0 114.256 -169.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.4 p -68.28 -35.48 77.92 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.911 -1.118 . . . . 0.0 112.539 171.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -68.92 119.45 13.27 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.177 1.391 . . . . 0.0 111.229 170.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -138.14 179.94 6.15 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.009 1.724 . . . . 0.0 111.249 -170.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -136.91 178.74 6.84 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.817 2.047 . . . . 0.0 110.127 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -144.03 -46.79 0.27 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.42 163.24 21.29 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -169.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -143.03 -17.67 0.66 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.115 1.366 . . . . 0.0 114.445 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -132.06 14.87 4.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.649 1.58 . . . . 0.0 112.317 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.5 mt -118.87 162.42 18.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.538 1.135 . . . . 0.0 113.613 -175.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.8 t -138.23 133.87 33.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 128.008 2.523 . . . . 0.0 107.385 169.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.21 144.05 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 111.081 -169.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -137.79 149.78 46.67 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.99 1.716 . . . . 0.0 110.226 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.6 mt -126.72 151.82 47.65 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.419 1.088 . . . . 0.0 112.069 -172.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -143.61 128.0 9.45 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.654 1.582 . . . . 0.0 110.016 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -79.1 -3.99 37.06 Favored 'Cis proline' 0 CA--C 1.547 1.169 0 CA-C-N 120.544 1.23 . . . . 0.0 113.36 -9.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -62.26 157.39 19.67 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -169.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -89.2 124.11 65.54 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 126.849 2.06 . . . . 0.0 109.968 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.23 81.59 2.42 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.465 2.777 . . . . 0.0 110.962 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -152.66 149.17 28.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.958 1.303 . . . . 0.0 112.529 -171.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -80.73 54.63 2.17 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.111 -0.993 . . . . 0.0 112.574 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 m -70.89 31.36 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.749 2.42 . . . . 0.0 115.305 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 58.68 15.97 4.06 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.017 2.127 . . . . 0.0 114.575 -172.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -149.22 162.38 29.11 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 125.539 1.536 . . . . 0.0 111.634 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.23 159.59 40.37 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.552 2.168 . . . . 0.0 110.668 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -85.54 -54.49 4.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.793 0.837 . . . . 0.0 109.895 171.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.6 t -83.03 137.73 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.598 1.159 . . . . 0.0 109.254 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 78.8 t -130.5 142.6 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-O 121.621 0.724 . . . . 0.0 110.754 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -128.66 123.66 59.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 128.147 2.579 . . . . 0.0 109.343 -169.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.9 mt -80.77 159.52 25.15 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 111.452 170.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.11 -24.54 67.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.422 1.089 . . . . 0.0 113.636 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.16 -10.04 59.31 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.856 1.663 . . . . 0.0 113.502 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.04 4.56 59.98 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.603 1.097 . . . . 0.0 114.988 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -72.36 141.56 48.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.637 1.218 . . . . 0.0 109.042 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -130.73 153.36 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.938 1.295 . . . . 0.0 109.966 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.8 p -49.5 120.48 10.61 Favored Pre-proline 0 N--CA 1.473 0.686 0 C-N-CA 124.767 1.227 . . . . 0.0 111.76 169.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.9 76.67 3.66 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.824 3.016 . . . . 0.0 111.901 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -115.88 -178.53 3.42 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.994 1.718 . . . . 0.0 112.797 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.2 m -138.8 150.85 46.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.141 0.972 . . . . 0.0 112.231 169.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.62 137.92 40.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 127.063 2.145 . . . . 0.0 108.389 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.6 tt -127.88 147.16 50.45 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.18 1.392 . . . . 0.0 110.475 -174.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.8 mtt -125.2 130.4 52.05 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 125.047 1.339 . . . . 0.0 109.46 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.08 146.7 50.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.921 1.689 . . . . 0.0 111.426 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -46.85 121.55 3.68 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.802 1.241 . . . . 0.0 111.145 171.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.04 -31.37 51.21 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -170.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.07 -21.24 7.84 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.614 0.626 . . . . 0.0 114.183 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.8 m -108.11 -21.71 12.68 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.902 0.881 . . . . 0.0 112.664 -169.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.29 -3.31 78.16 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.663 1.125 . . . . 0.0 114.951 173.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -69.47 122.11 84.51 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 125.599 1.56 . . . . 0.0 111.281 175.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -55.35 141.95 80.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.027 2.484 . . . . 0.0 113.082 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.07 -39.05 5.4 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.955 0.902 . . . . 0.0 110.267 169.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -149.97 154.69 38.67 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.08 1.352 . . . . 0.0 110.763 -169.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 6.6 m -139.42 145.0 38.35 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.898 1.679 . . . . 0.0 108.339 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.4 mt -123.24 134.79 54.08 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 127.408 2.283 . . . . 0.0 107.632 -175.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 7.7 t -136.02 138.82 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.488 0.715 . . . . 0.0 111.619 -168.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.0 t -114.82 124.98 53.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.221 1.008 . . . . 0.0 111.626 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 74.6 p -74.39 -16.83 60.88 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.171 1.389 . . . . 0.0 114.262 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.78 -1.1 12.13 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 125.504 1.526 . . . . 0.0 113.741 -169.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.6 t -154.93 158.77 39.78 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.093 -1.239 . . . . 0.0 113.054 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -59.92 137.21 90.61 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.127 1.771 . . . . 0.0 114.83 -178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -96.59 176.78 9.35 Favored 'Cis proline' 0 CA--C 1.548 1.191 0 CA-C-N 120.04 1.05 . . . . 0.0 111.026 -11.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.56 163.66 20.72 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.127 -0.983 . . . . 0.0 111.069 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -117.62 134.21 55.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.626 1.57 . . . . 0.0 111.23 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -89.49 146.08 24.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 111.855 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 t -150.36 147.99 28.26 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.151 1.38 . . . . 0.0 111.018 169.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.1 mp -74.76 128.81 36.46 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.557 -0.714 . . . . 0.0 109.116 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.02 63.42 0.26 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.281 1.832 . . . . 0.0 115.841 175.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.05 2.29 1.02 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.895 2.478 . . . . 0.0 116.74 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -54.11 -27.15 31.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -169.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.99 5.49 12.86 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.568 1.547 . . . . 0.0 112.582 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -71.51 -47.72 12.76 Favored Pre-proline 0 N--CA 1.476 0.835 0 CA-C-O 116.568 -1.682 . . . . 0.0 114.761 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 C--O 1.25 1.124 0 C-N-CA 122.546 2.164 . . . . 0.0 113.11 -179.158 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.488 1.461 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.46 -42.89 99.79 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.263 -0.898 . . . . 0.0 112.772 176.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.4 p90 -69.39 -23.58 63.74 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.92 160.66 25.24 Favored Glycine 0 CA--C 1.529 0.94 0 CA-C-N 119.226 0.921 . . . . 0.0 113.847 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.2 mtm-85 -131.0 82.69 2.06 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.648 1.979 . . . . 0.0 109.756 -171.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -49.31 -42.93 42.84 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 -170.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.99 -40.64 87.43 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.66 -45.88 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.225 0.61 . . . . 0.0 109.774 173.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.3 -46.55 88.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.545 0.738 . . . . 0.0 112.565 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -58.39 -51.49 69.58 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.615 0.766 . . . . 0.0 112.331 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.9 m -57.86 -47.6 82.26 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.362 0.665 . . . . 0.0 111.319 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -70.5 -29.27 65.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.854 1.261 . . . . 0.0 113.912 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.7 -49.28 71.5 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 120.576 1.535 . . . . 0.0 110.461 171.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -62.48 -40.54 97.01 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.768 1.227 . . . . 0.0 111.936 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -63.23 -47.83 80.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.598 1.159 . . . . 0.0 112.298 172.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.2 m -57.7 -40.66 80.03 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.067 0.947 . . . . 0.0 111.204 175.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.36 78.41 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.09 -44.63 96.25 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.566 -0.709 . . . . 0.0 111.665 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -68.28 -39.33 82.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.632 0.773 . . . . 0.0 112.42 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.04 -45.24 91.25 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.69 0.677 . . . . 0.0 111.83 169.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -60.81 -42.99 98.73 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.858 0.754 . . . . 0.0 110.73 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.94 -40.18 94.65 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.957 -1.089 . . . . 0.0 113.538 172.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.96 -31.13 71.86 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.27 1.028 . . . . 0.0 113.092 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.7 tp -73.33 -35.72 66.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.279 1.432 . . . . 0.0 111.427 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -62.11 -45.2 94.54 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.082 -1.011 . . . . 0.0 110.88 169.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 tp -51.9 -46.35 64.55 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.441 1.496 . . . . 0.0 111.075 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.82 97.73 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.26 -44.2 99.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.687 0.795 . . . . 0.0 110.598 175.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.56 -49.88 76.07 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.265 0.626 . . . . 0.0 111.562 174.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.0 mmt85 -59.28 -34.81 72.72 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.036 -1.04 . . . . 0.0 112.414 175.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.52 66.96 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.132 0.878 . . . . 0.0 111.765 178.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -25.04 63.11 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.633 -0.667 . . . . 0.0 112.523 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.7 mt -81.93 -43.08 18.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.682 1.193 . . . . 0.0 112.381 175.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.5 p -84.24 -17.5 39.58 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -173.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.87 11.68 83.48 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 175.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.89 172.56 6.18 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.185 1.394 . . . . 0.0 110.147 171.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.13 159.64 14.76 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.455 2.103 . . . . 0.0 114.907 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.6 t -130.52 156.49 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 127.249 2.219 . . . . 0.0 107.53 171.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.99 169.78 35.3 Favored Glycine 0 N--CA 1.468 0.814 0 CA-C-N 120.323 1.42 . . . . 0.0 116.256 -171.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.43 128.85 66.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 125.178 1.391 . . . . 0.0 108.829 -173.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -107.64 59.95 0.62 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 129.178 2.991 . . . . 0.0 110.635 -168.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -53.84 141.13 28.19 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.3 1.04 . . . . 0.0 112.056 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.5 t -139.42 179.52 6.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.067 1.747 . . . . 0.0 111.769 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -66.64 -16.93 64.55 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -169.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.0 p -142.81 -5.02 0.92 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.76 -175.36 5.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.065 1.746 . . . . 0.0 110.599 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -146.07 164.82 30.92 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.697 1.599 . . . . 0.0 109.851 173.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.6 ttp-105 -148.45 154.97 40.6 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.104 1.762 . . . . 0.0 109.814 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.3 mt -114.82 141.18 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.576 1.151 . . . . 0.0 109.272 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 85.3 mtp -132.6 148.33 52.36 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 -174.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.8 158.28 37.43 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.777 2.431 . . . . 0.0 108.86 -168.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.51 153.09 79.01 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 122.104 1.869 . . . . 0.0 112.034 169.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.3 4.72 0.98 Allowed Glycine 0 CA--C 1.537 1.406 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -137.59 -23.71 1.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.6 t -158.21 139.09 9.39 Favored Pre-proline 0 N--CA 1.477 0.911 0 CA-C-N 119.44 1.018 . . . . 0.0 112.829 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.63 -12.78 3.56 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.299 3.333 . . . . 0.0 112.187 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.7 t -82.96 -22.38 33.77 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.056 1.342 . . . . 0.0 113.479 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.78 162.06 37.69 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.349 1.46 . . . . 0.0 111.721 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -52.4 123.34 10.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.472 1.509 . . . . 0.0 112.429 177.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -153.23 160.18 42.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.518 1.527 . . . . 0.0 111.86 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -145.28 146.24 31.57 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.693 1.197 . . . . 0.0 113.6 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.1 t -158.01 153.65 22.66 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.993 2.917 . . . . 0.0 107.724 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -69.52 134.64 28.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.236 1.958 . . . . 0.0 111.064 173.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 tt -68.68 -26.28 65.22 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 123.328 1.537 . . . . 0.0 109.787 173.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -49.52 -14.31 0.11 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 127.968 2.507 . . . . 0.0 113.746 169.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -53.54 -32.74 51.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.929 1.692 . . . . 0.0 112.753 168.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -135.27 -13.04 2.1 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -176.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -121.58 58.24 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.209 1.403 . . . . 0.0 109.074 169.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.63 -23.43 1.01 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 -169.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -121.16 -4.2 9.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -171.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -129.08 -7.0 4.89 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.9 m -75.55 14.37 0.63 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.251 1.02 . . . . 0.0 113.603 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -155.63 -179.2 7.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.42 1.488 . . . . 0.0 110.988 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -51.93 128.02 22.93 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -168.86 -27.86 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.086 2.154 . . . . 0.0 111.439 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -69.23 -6.25 27.96 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.545 1.938 . . . . 0.0 114.796 -170.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.88 165.44 24.63 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.895 1.678 . . . . 0.0 113.442 -178.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.56 13.22 2.13 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.32 1.448 . . . . 0.0 112.841 171.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -155.09 3.48 0.2 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -168.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -120.19 162.87 18.62 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.292 -1.505 . . . . 0.0 113.482 -169.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 t -135.98 143.3 44.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.043 2.137 . . . . 0.0 108.735 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.9 143.88 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.116 1.366 . . . . 0.0 110.641 -169.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -140.17 134.51 31.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.352 1.461 . . . . 0.0 110.601 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mp -113.41 153.03 29.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.235 1.017 . . . . 0.0 113.15 -174.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -145.45 140.34 15.81 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 126.875 2.07 . . . . 0.0 108.745 -172.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -80.1 -5.95 41.37 Favored 'Cis proline' 0 CA--C 1.546 1.077 0 CA-C-N 120.841 1.336 . . . . 0.0 114.015 -3.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -107.35 155.96 19.43 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.84 1.256 . . . . 0.0 113.305 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.82 135.49 95.46 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -84.16 98.23 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 123.633 2.889 . . . . 0.0 108.797 168.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -148.0 156.38 42.59 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.028 -1.045 . . . . 0.0 112.259 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 41.75 0.28 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.99 1.716 . . . . 0.0 112.093 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 55.5 p -73.2 39.18 0.09 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.622 1.969 . . . . 0.0 115.281 -171.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.6 t30 57.33 19.5 5.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 127.022 2.129 . . . . 0.0 115.015 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -158.04 124.33 2.49 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.626 1.17 . . . . 0.0 110.429 -169.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.89 128.94 30.92 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 121.712 1.608 . . . . 0.0 111.212 172.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -78.34 -39.24 40.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.953 0.901 . . . . 0.0 111.311 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -99.98 136.23 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.896 1.678 . . . . 0.0 108.174 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.5 t -135.54 143.82 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 121.868 0.842 . . . . 0.0 111.108 -172.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -125.49 129.56 72.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 128.384 2.674 . . . . 0.0 107.968 -171.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.4 mt -94.08 162.62 13.8 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.097 0.951 . . . . 0.0 112.061 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.74 -9.41 6.36 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -175.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -121.12 9.74 10.57 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.746 1.619 . . . . 0.0 113.298 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.74 8.69 59.22 Favored Glycine 0 CA--C 1.535 1.304 0 N-CA-C 115.833 1.093 . . . . 0.0 115.833 173.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -74.93 137.8 41.92 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.9 1.35 . . . . 0.0 108.551 169.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.37 146.11 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.909 1.284 . . . . 0.0 109.479 -173.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.2 p -52.24 124.37 30.77 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 124.022 0.929 . . . . 0.0 111.539 170.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.64 112.87 3.59 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.742 2.295 . . . . 0.0 111.096 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.547 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.5 p90 -151.45 -179.27 7.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.35 1.86 . . . . 0.0 111.661 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -138.19 142.48 40.03 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.622 0.769 . . . . 0.0 112.156 169.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.07 102.77 8.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 129.235 3.014 . . . . 0.0 108.833 -170.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -96.62 147.9 23.4 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.544 1.138 . . . . 0.0 110.563 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.4 mtt -129.85 135.48 48.44 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.879 1.672 . . . . 0.0 109.271 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.66 152.71 48.3 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.158 1.383 . . . . 0.0 111.0 -176.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -61.09 127.28 30.78 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 121.814 -0.554 . . . . 0.0 109.806 175.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.97 -20.34 57.11 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -175.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.85 -32.65 0.68 Allowed Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.301 0.953 . . . . 0.0 114.582 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 6.9 m -68.38 -27.47 66.26 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.257 1.528 . . . . 0.0 111.255 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 70.55 35.82 68.06 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.806 0.717 . . . . 0.0 113.195 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -133.34 135.61 25.7 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 125.668 1.587 . . . . 0.0 110.439 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.41 152.33 79.0 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.012 2.475 . . . . 0.0 113.071 -176.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.34 -55.21 1.76 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.214 1.805 . . . . 0.0 111.565 -173.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -147.98 156.47 42.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 108.643 -169.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.6 m -147.46 138.56 23.65 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.059 -1.026 . . . . 0.0 110.243 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -109.61 146.21 35.13 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 126.814 2.046 . . . . 0.0 109.729 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 54.0 t -140.38 137.17 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.098 0.959 . . . . 0.0 112.038 -169.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.547 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 38.4 t -115.27 154.26 29.41 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.906 1.682 . . . . 0.0 111.641 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.4 m -130.35 9.52 5.18 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.944 1.298 . . . . 0.0 113.488 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.87 -9.61 10.45 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 114.943 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.9 p -156.53 160.07 39.15 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.637 1.219 . . . . 0.0 113.517 -173.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.0 t-105 -60.23 138.5 91.65 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.297 1.839 . . . . 0.0 115.501 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -97.9 177.22 7.93 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.128 1.081 . . . . 0.0 110.935 -11.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.26 160.26 32.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.855 169.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -100.81 166.04 11.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.065 1.346 . . . . 0.0 109.046 169.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -142.07 153.12 43.94 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.2 t -155.86 167.09 31.53 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.233 1.413 . . . . 0.0 112.254 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.89 135.85 48.25 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 109.971 169.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.98 70.5 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.724 2.41 . . . . 0.0 116.547 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 46.4 ptt85 44.03 31.6 0.54 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 128.798 2.839 . . . . 0.0 118.398 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -55.37 -24.04 27.58 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 174.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.6 p -97.43 -0.89 45.43 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.822 2.049 . . . . 0.0 113.759 176.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -138.54 62.18 28.17 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 126.33 1.852 . . . . 0.0 110.743 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.268 3.312 . . . . 0.0 113.369 178.968 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.22 165.84 33.59 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.063 1.345 . . . . 0.0 111.525 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -128.44 17.34 6.48 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.065 1.346 . . . . 0.0 113.385 -177.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.33 36.05 0.44 Allowed Glycine 0 CA--C 1.538 1.477 0 C-N-CA 126.575 2.036 . . . . 0.0 115.763 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.7 mtt-85 -61.45 -14.29 27.37 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.365 1.866 . . . . 0.0 114.357 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -51.1 -28.16 10.02 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -175.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.8 -13.51 34.29 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.865 1.266 . . . . 0.0 114.084 172.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -131.71 -44.2 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.681 1.992 . . . . 0.0 111.181 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.56 79.58 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.448 1.499 . . . . 0.0 113.331 -177.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -65.55 -44.79 85.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.158 0.89 . . . . 0.0 111.207 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.3 m -62.01 -45.82 91.94 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.282 -0.886 . . . . 0.0 111.593 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -60.04 -38.55 83.1 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.328 -0.844 . . . . 0.0 112.253 175.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.81 -47.27 87.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.493 1.042 . . . . 0.0 112.032 174.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -63.54 -41.4 98.45 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.217 1.007 . . . . 0.0 111.379 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.98 -53.32 51.97 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 122.694 0.398 . . . . 0.0 111.782 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.0 m -55.76 -37.12 68.1 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.964 1.306 . . . . 0.0 111.425 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.14 -47.74 83.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.38 1.072 . . . . 0.0 113.89 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.81 98.13 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.389 -0.819 . . . . 0.0 112.254 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -65.08 -42.59 93.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.485 0.714 . . . . 0.0 110.959 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -60.08 -43.71 95.3 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.199 0.6 . . . . 0.0 112.408 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 34.9 m -59.82 -41.79 92.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 118.597 0.635 . . . . 0.0 111.156 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.39 -40.88 94.02 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.864 -1.148 . . . . 0.0 113.5 172.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.75 -33.51 75.82 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.171 -0.956 . . . . 0.0 113.041 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.49 -35.85 75.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.448 1.099 . . . . 0.0 111.742 173.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.36 -44.22 95.44 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.91 -1.119 . . . . 0.0 111.773 170.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.57 -45.15 62.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.188 1.395 . . . . 0.0 111.471 169.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.09 98.11 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.64 -45.79 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 118.898 0.772 . . . . 0.0 110.713 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.87 -23.95 66.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -103.03 -24.78 13.61 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.33 74.59 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.983 1.265 . . . . 0.0 113.801 176.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.7 t -69.4 -28.28 66.02 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 121.637 -0.664 . . . . 0.0 112.73 173.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.4 mt -85.2 -28.59 25.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.518 1.527 . . . . 0.0 113.219 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -86.44 -15.73 39.34 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -169.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.1 -9.3 33.3 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 124.507 1.051 . . . . 0.0 115.266 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -138.32 150.84 68.03 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 129.447 3.099 . . . . 0.0 105.406 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -40.41 154.97 0.05 OUTLIER 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.099 3.199 . . . . 0.0 115.507 169.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.9 t -104.01 161.84 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.871 1.268 . . . . 0.0 108.311 171.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -154.44 176.28 32.3 Favored Glycine 0 CA--C 1.522 0.521 0 CA-C-O 122.299 0.944 . . . . 0.0 114.991 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 63.2 mt -134.95 118.42 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 124.504 1.122 . . . . 0.0 108.002 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -76.8 152.97 35.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.347 1.459 . . . . 0.0 110.687 170.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -143.02 147.85 35.79 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.391 1.477 . . . . 0.0 113.03 -175.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.7 p -136.58 -176.36 4.32 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.569 1.948 . . . . 0.0 111.302 176.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.63 -25.29 62.55 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 178.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.6 p -143.2 -2.09 1.02 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -173.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.73 179.87 7.15 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.86 1.314 . . . . 0.0 112.988 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.458 ' CZ2' ' HA ' ' A' ' 74' ' ' ASN . 58.6 p-90 -149.15 162.78 39.3 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.303 2.241 . . . . 0.0 108.762 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 41.8 mtm-85 -143.96 132.04 21.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.402 1.081 . . . . 0.0 111.208 172.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.3 mm -69.76 130.82 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 171.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.8 mtm -134.11 147.79 50.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 122.077 0.942 . . . . 0.0 111.719 -176.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.7 164.83 33.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.912 1.285 . . . . 0.0 111.786 -169.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.03 -23.41 75.68 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.755 2.97 . . . . 0.0 114.527 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.86 -53.53 1.69 Allowed Glycine 0 CA--C 1.533 1.201 0 C-N-CA 126.929 2.204 . . . . 0.0 116.556 169.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -142.62 -23.05 0.66 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.294 1.437 . . . . 0.0 114.299 -172.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.3 t -133.32 124.12 18.06 Favored Pre-proline 0 N--CA 1.475 0.805 0 CA-C-N 119.021 0.828 . . . . 0.0 113.021 -174.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -86.55 -0.02 8.04 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.82 3.013 . . . . 0.0 111.929 169.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.7 m -111.74 -5.22 14.46 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.662 1.585 . . . . 0.0 114.262 -169.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -141.79 146.04 35.46 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.064 1.346 . . . . 0.0 110.839 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -51.27 -37.26 46.33 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.95 1.7 . . . . 0.0 115.047 -171.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 9.2 tpt85 -27.32 96.97 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 129.007 2.923 . . . . 0.0 115.241 -171.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.22 154.82 34.97 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.305 1.042 . . . . 0.0 112.124 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.6 m -143.82 151.0 51.97 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 125.886 1.674 . . . . 0.0 110.164 169.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.14 145.87 80.02 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.183 1.922 . . . . 0.0 110.21 169.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 63.6 tp -57.12 -71.84 0.09 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.337 1.055 . . . . 0.0 113.595 -169.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 43.83 1.79 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 130.612 3.565 . . . . 0.0 120.45 169.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -60.42 -21.76 62.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.499 1.919 . . . . 0.0 115.351 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -150.35 -38.94 0.14 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.951 1.701 . . . . 0.0 110.698 170.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.78 44.35 0.08 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.112 2.165 . . . . 0.0 113.12 169.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.31 20.44 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 -169.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -133.36 25.96 4.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.084 1.354 . . . . 0.0 112.033 170.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -120.19 -6.89 9.89 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.848 1.659 . . . . 0.0 111.679 173.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.9 m -71.16 -2.12 14.75 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.804 1.642 . . . . 0.0 113.123 169.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -139.5 168.99 18.58 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.571 1.548 . . . . 0.0 113.253 -175.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.458 ' HA ' ' CZ2' ' A' ' 47' ' ' TRP . 59.0 t30 -51.13 119.55 4.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 117.307 2.336 . . . . 0.0 117.307 -169.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -141.72 10.19 2.01 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.54 2.336 . . . . 0.0 111.459 169.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -79.52 -17.23 54.5 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.03 1.332 . . . . 0.0 113.529 -176.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.11 167.3 28.15 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -144.08 27.71 1.43 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.802 2.041 . . . . 0.0 110.247 169.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -141.45 -5.81 1.06 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.442 1.497 . . . . 0.0 114.636 -169.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.2 mt -115.3 163.4 15.74 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.865 1.317 . . . . 0.0 113.614 -170.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.2 t -134.38 134.79 42.1 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 128.672 2.789 . . . . 0.0 106.797 169.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.51 144.26 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.421 1.088 . . . . 0.0 110.884 -169.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -137.36 157.4 46.67 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.028 1.731 . . . . 0.0 109.585 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -153.71 168.56 25.84 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.546 -0.721 . . . . 0.0 112.902 172.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -157.65 155.08 26.43 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.525 1.93 . . . . 0.0 110.269 177.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -77.46 -10.75 31.7 Favored 'Cis proline' 0 CA--C 1.543 0.946 0 CA-C-N 120.898 1.357 . . . . 0.0 114.864 2.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -66.1 -178.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.303 1.441 . . . . 0.0 111.586 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.73 141.11 29.63 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -176.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.39 131.44 24.8 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.825 2.35 . . . . 0.0 110.407 175.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -160.38 -154.52 0.38 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.587 0.755 . . . . 0.0 111.523 -169.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -135.71 26.81 3.36 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.954 2.502 . . . . 0.0 110.148 169.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.2 m -60.37 156.87 14.9 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.124 2.17 . . . . 0.0 115.086 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -71.96 20.05 0.06 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 126.031 1.732 . . . . 0.0 114.84 175.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -150.36 161.29 31.11 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.379 1.872 . . . . 0.0 109.823 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.99 172.07 16.24 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 122.902 2.402 . . . . 0.0 112.964 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -108.64 -10.58 15.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.87 1.668 . . . . 0.0 111.958 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.56 139.33 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.238 1.415 . . . . 0.0 108.811 169.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 58.8 t -134.31 139.3 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 109.577 -175.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.92 119.16 48.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 126.635 1.974 . . . . 0.0 109.5 -169.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.64 152.27 40.55 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.373 1.469 . . . . 0.0 111.187 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.01 -28.64 58.15 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.895 1.278 . . . . 0.0 114.127 172.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.94 -11.31 59.59 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.628 1.571 . . . . 0.0 113.58 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.25 4.77 59.62 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 124.648 1.118 . . . . 0.0 114.887 -177.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -72.24 150.99 43.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.491 1.145 . . . . 0.0 108.408 169.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -128.82 137.55 56.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 124.774 1.23 . . . . 0.0 108.427 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 6.3 t -56.26 133.34 75.61 Favored Pre-proline 0 CA--C 1.544 0.75 0 CA-C-O 118.522 -0.752 . . . . 0.0 111.255 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -59.94 117.53 4.29 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.562 2.175 . . . . 0.0 112.82 174.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 5.6 p90 -155.13 175.6 13.63 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.448 1.499 . . . . 0.0 111.356 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 p -142.14 153.2 43.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.499 1.12 . . . . 0.0 110.508 169.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.12 134.67 33.18 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.884 2.073 . . . . 0.0 109.142 -169.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -125.71 143.17 51.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.461 1.504 . . . . 0.0 110.383 -175.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.4 mtt -122.07 128.98 51.98 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.556 1.542 . . . . 0.0 109.667 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.11 146.16 50.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.64 1.576 . . . . 0.0 111.573 -175.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -54.18 124.98 17.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.48 1.112 . . . . 0.0 109.927 171.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.55 -14.07 17.76 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 -174.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -103.9 -50.05 1.04 Allowed Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.917 1.246 . . . . 0.0 113.417 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.4 p -79.45 -27.77 41.62 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.442 1.121 . . . . 0.0 113.558 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.97 8.27 73.05 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.987 0.803 . . . . 0.0 113.01 -169.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.38 134.66 58.22 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 124.901 1.28 . . . . 0.0 110.836 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.57 144.13 65.38 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.787 2.325 . . . . 0.0 112.663 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.24 -40.38 4.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.922 0.889 . . . . 0.0 110.125 169.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.45 154.81 38.36 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.327 1.051 . . . . 0.0 111.383 -169.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.9 m -145.75 145.78 30.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.966 1.307 . . . . 0.0 109.986 177.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.5 mp -120.17 144.55 47.63 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.122 2.569 . . . . 0.0 109.365 -179.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 15.9 t -142.23 138.07 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.253 1.021 . . . . 0.0 111.581 -170.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 10.6 t -116.7 152.89 33.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.432 1.093 . . . . 0.0 112.234 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 39.6 m -130.5 5.86 4.77 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.312 1.445 . . . . 0.0 113.19 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.85 -15.25 5.43 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 115.915 1.126 . . . . 0.0 115.915 172.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.2 t -151.64 159.04 44.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.76 1.78 . . . . 0.0 113.798 -172.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 -57.5 135.28 82.02 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 126.465 1.906 . . . . 0.0 115.524 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -96.28 175.98 10.34 Favored 'Cis proline' 0 CA--C 1.547 1.146 0 CA-C-N 120.139 1.086 . . . . 0.0 110.603 -11.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.43 161.75 22.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.245 1.022 . . . . 0.0 112.085 169.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -90.12 154.79 19.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.208 1.403 . . . . 0.0 107.788 169.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -139.44 152.54 47.12 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.3 t -155.18 151.35 28.09 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.692 1.197 . . . . 0.0 112.031 -169.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.98 131.92 45.85 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 169.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.57 66.08 0.12 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.628 1.971 . . . . 0.0 115.267 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 52.05 13.77 0.29 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 118.58 2.808 . . . . 0.0 118.58 178.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -57.51 -32.17 66.76 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -169.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 68.3 p -79.77 -18.21 51.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 68.4 ttt-85 -66.73 -47.03 56.54 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-O 116.54 -1.695 . . . . 0.0 115.263 -171.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo . . . . . 0 C--O 1.249 1.071 0 C-N-CA 122.729 2.286 . . . . 0.0 113.223 -178.428 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.569 -0.16 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.56 167.85 24.31 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.131 1.372 . . . . 0.0 111.75 177.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -67.98 -14.51 63.02 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -167.03 -174.7 36.47 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.534 1.54 . . . . 0.0 112.824 -178.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -78.28 57.85 1.97 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.744 1.618 . . . . 0.0 113.969 -170.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -46.54 -42.48 15.85 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.796 2.038 . . . . 0.0 114.385 -178.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -66.57 -42.07 87.62 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.24 -40.05 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.716 -0.659 . . . . 0.0 109.987 175.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.3 95.95 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.311 0.959 . . . . 0.0 112.659 173.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.19 -42.43 96.65 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.049 -1.032 . . . . 0.0 111.575 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.0 m -61.16 -50.37 73.42 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.745 0.818 . . . . 0.0 111.711 173.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -57.46 -40.4 78.44 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.914 1.686 . . . . 0.0 112.408 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.98 72.01 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.989 0.813 . . . . 0.0 111.376 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -61.73 -41.69 97.99 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.129 0.972 . . . . 0.0 111.876 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.47 -50.01 71.38 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.767 1.227 . . . . 0.0 112.538 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 61.8 m -65.28 -30.26 71.11 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.237 -0.915 . . . . 0.0 112.113 174.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.9 87.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.679 1.127 . . . . 0.0 113.496 172.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.85 -43.76 98.2 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.35 -0.844 . . . . 0.0 111.372 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -64.76 -39.2 93.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.525 0.73 . . . . 0.0 112.664 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -61.31 -42.5 98.77 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 111.774 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.8 m -59.32 -43.86 92.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.424 0.556 . . . . 0.0 110.727 175.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -41.87 96.5 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.981 -1.075 . . . . 0.0 113.474 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.86 -32.71 74.32 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.997 0.919 . . . . 0.0 113.128 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.9 tp -73.04 -33.87 65.96 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.06 1.344 . . . . 0.0 111.683 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.41 -44.23 95.26 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.948 -1.095 . . . . 0.0 110.877 169.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.7 -45.33 66.82 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.34 1.456 . . . . 0.0 111.288 169.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.61 98.03 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.92 -47.29 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.088 0.858 . . . . 0.0 110.684 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -60.34 -35.44 75.65 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.708 0.803 . . . . 0.0 112.796 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -76.29 -36.63 58.26 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.389 0.676 . . . . 0.0 112.626 174.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.92 -36.06 82.72 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.833 1.197 . . . . 0.0 112.96 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -73.32 -27.32 61.46 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.9 -25.34 23.3 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.9 m -89.28 -22.07 22.88 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -169.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.75 5.85 89.27 Favored Glycine 0 CA--C 1.542 1.734 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -143.44 150.81 52.67 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 127.653 2.381 . . . . 0.0 107.302 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -46.24 163.25 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.761 2.974 . . . . 0.0 114.593 169.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -123.37 160.72 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.616 1.566 . . . . 0.0 108.459 176.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.63 173.75 34.37 Favored Glycine 0 CA--C 1.521 0.458 0 N-CA-C 116.111 1.204 . . . . 0.0 116.111 -177.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.2 mt -132.63 123.66 49.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.832 1.253 . . . . 0.0 108.998 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -83.48 145.76 28.76 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.597 1.959 . . . . 0.0 110.758 170.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -141.55 145.2 34.82 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.311 1.445 . . . . 0.0 111.801 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.2 p -146.83 176.12 10.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.996 1.318 . . . . 0.0 112.056 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -61.09 -10.11 5.66 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.445 1.098 . . . . 0.0 113.86 170.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.9 m -130.7 -15.8 3.44 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.92 168.73 24.82 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 123.178 1.466 . . . . 0.0 114.079 -178.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -135.74 144.33 45.8 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.904 2.882 . . . . 0.0 105.478 169.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -160.01 129.62 5.26 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.674 0.79 . . . . 0.0 111.508 -172.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mt -92.57 139.36 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.2 mtp -136.66 145.27 44.59 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.038 0.935 . . . . 0.0 112.189 -169.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 m -138.46 160.79 62.22 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 126.574 1.95 . . . . 0.0 112.137 -169.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -81.17 12.04 2.82 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.048 3.165 . . . . 0.0 115.406 -171.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -39.66 -40.17 1.44 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 127.005 2.24 . . . . 0.0 118.687 -169.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -69.1 -44.5 72.35 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.219 1.51 . . . . 0.0 112.895 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -167.92 129.87 1.24 Allowed Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 123.935 0.894 . . . . 0.0 112.83 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.2 -24.6 6.55 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.029 2.486 . . . . 0.0 111.725 169.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.4 m -75.18 -24.86 57.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.542 1.537 . . . . 0.0 113.517 -175.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.48 21.06 4.73 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.339 1.455 . . . . 0.0 112.674 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . 0.27 0.0 OUTLIER 54.08 -13.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 131.567 3.947 . . . . 0.0 120.288 173.475 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -38.74 110.01 0.12 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 128.062 2.545 . . . . 0.0 114.198 -170.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.87 153.92 40.64 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.172 1.389 . . . . 0.0 113.92 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 t -136.49 140.59 32.84 Favored Pre-proline 0 N--CA 1.469 0.495 0 C-N-CA 126.891 2.076 . . . . 0.0 108.194 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -63.53 151.71 83.69 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 CA-C-N 121.156 1.449 . . . . 0.0 109.716 169.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 15.8 tp -65.65 12.7 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -176.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -61.38 -13.53 20.64 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.022 -1.674 . . . . 0.0 114.077 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.58 -15.09 24.3 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.358 1.063 . . . . 0.0 113.424 169.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -141.58 -44.59 0.36 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.091 1.356 . . . . 0.0 112.389 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.56 47.69 1.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.212 1.805 . . . . 0.0 111.697 173.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.7 -35.15 1.71 Allowed 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 -169.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -129.08 15.25 6.26 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.212 1.405 . . . . 0.0 112.578 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -143.46 6.05 1.45 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -174.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 82.6 p -58.18 -20.13 38.69 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -157.95 168.89 25.87 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.49 1.516 . . . . 0.0 113.48 -169.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.81 -41.1 0.07 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.84 3.256 . . . . 0.0 118.008 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -73.19 70.42 1.12 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.309 1.844 . . . . 0.0 111.331 176.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -129.15 -28.71 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -168.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.58 176.65 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.413 1.006 . . . . 0.0 113.642 -176.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -125.93 -25.04 3.67 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.579 1.952 . . . . 0.0 113.477 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -139.17 14.53 2.62 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.383 1.073 . . . . 0.0 113.599 -169.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -124.16 156.19 37.14 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -168.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.3 m -133.01 134.3 44.25 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.565 2.746 . . . . 0.0 107.806 169.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -113.37 141.51 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.366 1.066 . . . . 0.0 110.55 -169.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -140.1 85.56 2.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.554 1.542 . . . . 0.0 110.426 -170.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.3 157.22 37.43 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.928 -1.107 . . . . 0.0 112.486 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.82 145.34 27.45 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.852 1.661 . . . . 0.0 109.365 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.56 -14.29 24.46 Favored 'Cis proline' 0 CA--C 1.543 0.975 0 CA-C-N 120.076 1.063 . . . . 0.0 113.825 -4.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -60.62 119.95 9.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.142 1.377 . . . . 0.0 112.328 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.43 145.83 85.89 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.262 1.025 . . . . 0.0 113.505 -177.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.92 63.96 8.73 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 124.311 3.341 . . . . 0.0 112.386 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -147.67 159.13 44.12 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.158 1.383 . . . . 0.0 111.735 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -74.34 89.63 2.1 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.655 1.217 . . . . 0.0 113.594 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 p -61.02 -3.41 0.79 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 128.043 2.537 . . . . 0.0 116.224 171.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 2.6 p30 54.31 6.9 0.12 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.476 2.31 . . . . 0.0 115.82 -169.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -140.84 165.37 30.04 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 128.66 2.784 . . . . 0.0 108.23 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.2 155.09 65.26 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-N 120.094 1.069 . . . . 0.0 112.155 169.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -102.37 -44.55 5.36 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.595 1.158 . . . . 0.0 110.72 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.79 135.72 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 89.7 t -136.04 139.12 46.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.684 1.194 . . . . 0.0 109.745 -177.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.5 119.43 50.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 127.578 2.351 . . . . 0.0 108.206 -170.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -83.23 159.55 21.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.768 0.794 . . . . 0.0 111.355 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.25 -26.12 50.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.074 1.349 . . . . 0.0 114.449 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -76.01 -16.67 59.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.805 1.642 . . . . 0.0 113.595 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.05 7.14 64.41 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.331 0.967 . . . . 0.0 114.498 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -84.66 143.23 29.35 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 169.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.4 mm -125.75 149.77 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.14 1.376 . . . . 0.0 109.966 -168.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.8 t -56.34 134.07 76.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 O-C-N 121.655 -0.653 . . . . 0.0 110.925 169.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -75.65 117.35 4.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.51 2.14 . . . . 0.0 111.216 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.498 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 10.1 p90 -149.05 179.09 8.14 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 127.055 2.142 . . . . 0.0 111.021 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -138.59 155.54 48.25 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 111.246 169.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.4 tp -136.97 103.72 5.24 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.875 2.07 . . . . 0.0 108.985 -169.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -95.19 147.09 23.83 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.364 0.665 . . . . 0.0 110.446 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 59.0 mtt -126.7 125.66 42.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.741 1.616 . . . . 0.0 110.392 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.79 140.1 52.25 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.205 1.402 . . . . 0.0 111.55 -176.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -64.52 119.38 10.34 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.142 0.977 . . . . 0.0 110.565 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.43 -22.03 52.93 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 178.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -84.38 -19.57 60.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.724 1.154 . . . . 0.0 115.269 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.2 p -135.18 -24.56 1.42 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.276 1.538 . . . . 0.0 114.445 -170.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 84.6 -1.78 88.56 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.975 1.274 . . . . 0.0 114.105 -172.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -79.45 138.97 55.18 Favored Pre-proline 0 CA--C 1.545 0.773 0 CA-C-N 118.682 1.241 . . . . 0.0 112.22 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.14 146.42 57.81 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.779 2.319 . . . . 0.0 111.642 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.94 -42.06 2.85 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.976 0.91 . . . . 0.0 111.265 174.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -148.86 159.73 43.9 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.589 1.156 . . . . 0.0 111.245 -168.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.8 m -148.2 139.99 23.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.728 1.211 . . . . 0.0 109.521 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.9 mp -109.55 144.82 37.32 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.524 1.93 . . . . 0.0 109.374 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 35.1 t -138.48 136.14 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.654 1.182 . . . . 0.0 111.366 -169.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.498 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 20.1 t -115.98 154.87 29.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.108 1.363 . . . . 0.0 111.843 178.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 m -131.98 9.95 4.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.187 1.395 . . . . 0.0 113.267 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 115.89 -6.75 19.81 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.85 1.214 . . . . 0.0 115.217 176.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 73.4 m -149.05 150.66 33.15 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.649 1.224 . . . . 0.0 113.33 -169.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -58.45 137.0 85.66 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 124.909 1.284 . . . . 0.0 114.41 173.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.17 174.66 11.54 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 CA-C-N 120.147 1.088 . . . . 0.0 111.032 -11.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.28 166.01 15.13 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.076 0.941 . . . . 0.0 110.937 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -110.54 165.05 12.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.999 1.32 . . . . 0.0 109.132 171.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -141.98 155.66 45.45 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.4 t -151.87 151.08 30.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.678 1.591 . . . . 0.0 111.005 -173.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.73 133.04 47.82 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 67.91 0.07 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.871 2.068 . . . . 0.0 115.431 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 0.0 OUTLIER 50.05 16.47 0.24 Allowed 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.28 -34.32 70.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.5 p -88.26 -12.31 44.02 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 174.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -61.8 134.91 94.2 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.011 0.925 . . . . 0.0 112.523 -169.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo . . . . . 0 C--O 1.25 1.088 0 C-N-CA 123.691 2.927 . . . . 0.0 113.264 168.878 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.28 167.26 4.24 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.323 1.049 . . . . 0.0 113.612 175.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 p90 -58.7 -27.55 64.95 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.756 1.222 . . . . 0.0 114.136 176.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -178.83 159.79 25.06 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.756 1.17 . . . . 0.0 112.643 176.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 54.0 mmm-85 -84.29 63.54 7.81 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.901 1.281 . . . . 0.0 112.389 -175.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -48.46 -41.23 28.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.175 0.99 . . . . 0.0 112.045 173.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.46 -11.59 16.94 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.801 2.04 . . . . 0.0 115.156 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.07 -44.44 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 125.652 1.581 . . . . 0.0 110.088 173.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.23 -38.42 86.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -56.23 -50.02 72.48 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.275 0.943 . . . . 0.0 112.65 172.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.6 m -64.77 -49.59 70.16 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.564 0.746 . . . . 0.0 111.131 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -72.16 -26.82 62.24 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -172.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.06 -53.32 58.62 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.44 1.018 . . . . 0.0 110.767 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -66.47 -36.56 83.07 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.286 0.634 . . . . 0.0 112.502 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -59.69 -48.6 81.02 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.17 169.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.3 m -58.93 -41.51 87.52 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.538 0.735 . . . . 0.0 111.179 176.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.62 -40.4 88.76 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 175.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.7 96.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.339 -0.851 . . . . 0.0 111.533 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.34 -44.56 96.2 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.829 0.852 . . . . 0.0 111.704 174.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -59.81 -44.34 94.06 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 172.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 48.3 m -61.16 -44.04 97.94 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.819 0.736 . . . . 0.0 110.8 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.76 95.36 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.053 -1.029 . . . . 0.0 113.165 172.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.18 -33.94 77.2 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.016 0.926 . . . . 0.0 113.143 175.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -71.7 -33.16 68.55 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.654 1.182 . . . . 0.0 112.143 171.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -63.93 -43.74 94.96 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.888 -1.132 . . . . 0.0 111.14 169.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.33 -45.54 69.11 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.77 1.628 . . . . 0.0 111.255 169.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.32 -47.04 86.01 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.478 0.711 . . . . 0.0 112.394 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -59.11 -41.23 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.787 -1.196 . . . . 0.0 111.401 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.04 -42.32 97.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.439 0.696 . . . . 0.0 112.768 172.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -63.44 -35.08 79.24 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.603 1.161 . . . . 0.0 112.943 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.0 95.07 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -174.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.3 t -76.85 -23.08 52.71 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 98.6 mt -89.61 -36.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.64 1.176 . . . . 0.0 113.172 -176.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.0 p -84.34 -16.58 42.41 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.47 -0.01 76.95 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -142.59 149.25 49.92 Favored Pre-proline 0 N--CA 1.471 0.582 0 C-N-CA 126.438 1.895 . . . . 0.0 108.576 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -47.66 144.81 10.25 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.214 1.942 . . . . 0.0 111.077 168.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.5 m -109.39 175.12 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.773 0.829 . . . . 0.0 111.15 -178.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.38 165.69 30.95 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 115.408 0.923 . . . . 0.0 115.408 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.47 116.07 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 124.915 1.286 . . . . 0.0 107.955 177.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 34.5 t-80 -80.52 147.14 30.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 126.775 2.03 . . . . 0.0 111.243 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.9 142.18 30.65 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.706 1.602 . . . . 0.0 111.622 -179.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 24.1 p -132.94 177.0 7.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.782 1.633 . . . . 0.0 111.553 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -57.99 -14.72 7.0 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 170.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.9 m -137.06 -10.72 1.74 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -169.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.34 174.4 15.49 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.932 1.242 . . . . 0.0 112.602 179.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 12.4 p90 -142.07 156.06 45.39 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.409 1.484 . . . . 0.0 110.018 169.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -150.91 151.93 32.89 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.167 1.387 . . . . 0.0 110.64 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 6.0 mt -109.15 141.84 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.977 0.808 . . . . 0.0 109.606 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.1 mtp -134.74 149.98 50.51 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.421 1.088 . . . . 0.0 111.407 -175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.4 m -142.48 169.19 11.38 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 127.073 2.149 . . . . 0.0 111.372 -169.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -55.94 -36.37 95.65 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.476 2.784 . . . . 0.0 114.862 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 66.14 -42.38 0.16 Allowed Glycine 0 CA--C 1.541 1.659 0 C-N-CA 127.147 2.308 . . . . 0.0 117.037 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -143.84 -31.25 0.47 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -172.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.4 p -134.0 57.06 22.06 Favored Pre-proline 0 N--CA 1.485 1.289 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -169.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.24 -20.51 70.29 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 122.871 2.381 . . . . 0.0 114.547 -177.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -64.11 -8.94 13.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.322 1.449 . . . . 0.0 114.453 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -135.98 -128.53 0.15 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.262 1.825 . . . . 0.0 110.595 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -139.53 118.42 12.48 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.685 1.594 . . . . 0.0 109.894 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -152.53 159.5 43.29 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.36 1.464 . . . . 0.0 110.654 176.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 40.8 m95 -136.4 130.32 32.55 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.695 1.198 . . . . 0.0 112.239 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.2 t -142.38 138.0 16.08 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 126.748 2.019 . . . . 0.0 108.051 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -50.77 131.6 34.3 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.223 2.615 . . . . 0.0 112.81 170.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 29.4 tp -68.28 108.14 3.08 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.033 0.933 . . . . 0.0 111.02 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -138.61 -13.15 1.3 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -54.48 -29.04 48.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.604 1.562 . . . . 0.0 114.382 -172.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -142.28 27.06 1.77 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.178 1.791 . . . . 0.0 111.769 169.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -143.42 39.04 1.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.692 2.397 . . . . 0.0 109.541 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.13 -24.03 2.51 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 117.033 2.235 . . . . 0.0 117.033 -168.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -132.34 20.51 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.635 1.574 . . . . 0.0 112.031 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -132.39 4.3 3.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.384 1.474 . . . . 0.0 113.29 -170.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -34.86 41.15 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.157 1.783 . . . . 0.0 114.705 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -130.86 151.08 51.68 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.533 1.933 . . . . 0.0 111.277 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.09 158.64 43.88 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.078 1.351 . . . . 0.0 112.493 -169.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -158.18 58.68 0.46 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.89 2.076 . . . . 0.0 109.006 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 9.7 m0 -59.91 -24.34 64.23 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 117.02 2.23 . . . . 0.0 117.02 -169.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 166.06 20.16 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.731 1.15 . . . . 0.0 113.791 -177.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -137.4 15.14 2.98 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.45 1.1 . . . . 0.0 112.638 169.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.51 7.6 0.25 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.879 1.271 . . . . 0.0 113.817 -171.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.76 169.44 13.85 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.479 1.511 . . . . 0.0 112.03 -172.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -138.61 140.92 39.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.565 1.946 . . . . 0.0 109.024 169.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.8 143.97 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 125.339 1.456 . . . . 0.0 110.258 -173.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -137.52 152.82 49.89 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.614 1.966 . . . . 0.0 109.728 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.5 tt -151.16 146.23 25.97 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.868 0.867 . . . . 0.0 111.98 -170.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -149.14 156.71 40.18 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 125.408 1.483 . . . . 0.0 110.517 169.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -77.2 -16.13 25.61 Favored 'Cis proline' 0 CA--C 1.541 0.843 0 CA-C-N 120.355 1.163 . . . . 0.0 114.128 -0.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -70.08 151.57 45.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.57 1.148 . . . . 0.0 113.418 -175.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -63.45 119.3 52.26 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.896 1.678 . . . . 0.0 112.582 178.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -80.29 64.85 8.92 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.137 3.225 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -145.92 157.3 43.9 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.262 1.425 . . . . 0.0 111.587 -174.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -66.7 75.46 0.11 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.826 1.65 . . . . 0.0 113.872 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.9 t -75.85 159.15 31.28 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.653 1.981 . . . . 0.0 113.146 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.16 -8.59 55.55 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.317 1.447 . . . . 0.0 113.085 169.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -134.41 163.97 47.33 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 125.825 1.65 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.34 145.16 37.97 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 121.549 1.5 . . . . 0.0 110.466 168.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -73.91 -53.24 10.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.227 1.011 . . . . 0.0 111.017 173.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.0 t -81.92 140.31 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.667 1.187 . . . . 0.0 109.496 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 53.7 t -130.91 142.9 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.959 0.903 . . . . 0.0 111.07 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.99 127.42 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 127.784 2.433 . . . . 0.0 108.736 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.3 mt -89.12 156.9 18.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.394 0.616 . . . . 0.0 111.307 170.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.2 -21.77 60.0 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -71.16 -20.27 62.32 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.976 1.71 . . . . 0.0 113.575 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.62 3.3 62.75 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.897 1.237 . . . . 0.0 114.775 -177.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.02 147.09 28.37 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 118.455 1.127 . . . . 0.0 108.663 169.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.1 mm -131.42 155.89 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 124.935 1.294 . . . . 0.0 110.241 -168.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.7 p -55.67 129.6 70.74 Favored Pre-proline 0 N--CA 1.471 0.587 0 O-C-N 121.273 -0.892 . . . . 0.0 110.224 169.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -71.89 119.88 6.49 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.186 1.924 . . . . 0.0 111.456 175.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.454 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 13.1 p90 -149.84 174.74 12.32 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.229 1.811 . . . . 0.0 111.337 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 94.7 p -137.53 151.62 48.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.683 0.754 . . . . 0.0 111.118 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -139.76 128.32 22.99 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.281 1.832 . . . . 0.0 108.48 -169.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -123.24 150.96 42.78 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.611 1.565 . . . . 0.0 110.275 -173.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.5 mtt -129.67 142.13 50.78 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.873 1.269 . . . . 0.0 109.614 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.5 143.65 41.8 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.02 1.328 . . . . 0.0 111.046 -177.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.19 122.09 15.28 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.683 0.674 . . . . 0.0 110.133 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.07 -23.32 65.38 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -176.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -97.5 -48.67 1.95 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.766 1.174 . . . . 0.0 113.037 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.3 m -66.87 -31.28 71.78 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 117.951 0.875 . . . . 0.0 112.046 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.68 30.63 61.59 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 123.998 0.809 . . . . 0.0 113.665 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -133.36 149.35 72.17 Favored Pre-proline 0 N--CA 1.474 0.729 0 C-N-CA 125.873 1.669 . . . . 0.0 111.218 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.17 152.03 83.57 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.173 2.582 . . . . 0.0 112.2 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.76 -45.87 1.17 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 126.082 1.753 . . . . 0.0 112.36 -169.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.4 tp -151.66 154.74 36.97 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.33 1.452 . . . . 0.0 109.275 -173.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -146.38 144.79 29.98 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 123.856 0.862 . . . . 0.0 109.628 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.5 mt -126.0 136.38 52.92 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.561 2.345 . . . . 0.0 108.168 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.99 126.93 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.399 1.08 . . . . 0.0 110.708 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.454 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 43.4 t -93.82 -44.31 8.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -172.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 20.4 m 54.18 -5.54 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 -173.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.65 -1.5 3.97 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.342 1.448 . . . . 0.0 116.001 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 6.2 t -156.67 156.18 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.858 1.829 . . . . 0.0 114.88 -172.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.5 t-105 -61.18 137.53 94.27 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 125.812 1.645 . . . . 0.0 114.937 175.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -94.69 174.58 13.72 Favored 'Cis proline' 0 CA--C 1.546 1.09 0 CA-C-N 120.048 1.053 . . . . 0.0 110.487 -11.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.29 145.72 55.42 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.625 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -96.9 127.56 42.99 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.092 1.757 . . . . 0.0 110.555 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -96.17 143.66 27.08 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.526 1.53 . . . . 0.0 112.252 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.1 t -147.35 151.96 37.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.582 1.553 . . . . 0.0 111.334 170.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.57 132.62 44.92 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.48 64.34 0.11 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.939 2.096 . . . . 0.0 115.732 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 0.0 OUTLIER 48.58 15.44 0.09 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 128.655 2.782 . . . . 0.0 117.891 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.25 -39.49 79.29 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.4 m -86.53 -15.05 41.21 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.51 1.124 . . . . 0.0 112.836 178.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 48.9 ttt-85 -66.98 138.02 94.91 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 120.991 -1.068 . . . . 0.0 112.237 -171.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 123.629 2.886 . . . . 0.0 113.137 168.648 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.4 mtm . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.309 0.1 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.22 -21.28 66.3 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 178.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 53.5 p90 -149.68 169.23 21.49 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.016 1.726 . . . . 0.0 111.412 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.14 -31.25 0.21 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 123.766 0.698 . . . . 0.0 114.712 177.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.1 mtp85 -73.83 6.34 3.35 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -53.72 -33.84 56.88 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -174.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.65 -36.15 78.21 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.311 -0.868 . . . . 0.0 112.6 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.3 t -73.55 -36.14 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.543 1.137 . . . . 0.0 110.584 173.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.86 70.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.605 1.162 . . . . 0.0 112.701 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -57.83 -56.53 20.73 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.418 1.008 . . . . 0.0 112.418 169.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.4 m -58.9 -46.24 88.36 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.604 0.761 . . . . 0.0 111.297 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -65.96 -36.11 82.44 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 117.516 -1.231 . . . . 0.0 113.249 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.28 70.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.889 1.677 . . . . 0.0 110.978 171.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -61.89 -40.8 96.68 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.734 1.214 . . . . 0.0 111.973 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.7 tp10 -64.37 -50.19 68.65 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.265 1.426 . . . . 0.0 112.465 173.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 92.2 m -58.5 -37.17 75.02 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.173 1.389 . . . . 0.0 111.032 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.41 -44.93 70.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.666 1.187 . . . . 0.0 114.142 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.367 -0.833 . . . . 0.0 111.571 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -67.39 -39.42 85.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.736 0.815 . . . . 0.0 112.315 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.33 -39.85 92.06 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.094 0.861 . . . . 0.0 112.068 171.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.6 m -58.83 -42.09 88.44 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.57 -0.707 . . . . 0.0 110.827 174.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.21 -36.92 85.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.793 -1.192 . . . . 0.0 113.973 171.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.71 -32.91 73.88 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 120.774 -1.204 . . . . 0.0 113.321 174.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.9 tp -70.07 -34.73 73.56 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.192 -0.942 . . . . 0.0 111.637 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -62.6 -45.22 93.87 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.162 -0.961 . . . . 0.0 111.579 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.1 tp -53.98 -48.22 70.58 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.522 1.129 . . . . 0.0 111.542 170.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.14 -42.17 80.48 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 176.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.11 -45.19 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.195 -0.941 . . . . 0.0 111.123 172.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.42 -6.83 7.98 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.578 1.551 . . . . 0.0 113.884 174.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 57.4 mmt-85 -109.54 -31.36 7.53 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.932 1.293 . . . . 0.0 112.139 172.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.33 -33.49 74.79 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.037 1.289 . . . . 0.0 113.055 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 t -69.5 -15.34 63.23 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 173.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 67.7 mt -112.71 -30.9 6.92 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.554 1.542 . . . . 0.0 114.15 -173.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.6 m -77.59 -21.36 52.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -169.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.3 -5.19 60.53 Favored Glycine 0 CA--C 1.543 1.787 0 N-CA-C 115.284 0.874 . . . . 0.0 115.284 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -136.48 150.32 70.13 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 128.428 2.691 . . . . 0.0 106.566 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -45.9 151.49 1.38 Allowed 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.819 2.346 . . . . 0.0 112.815 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.4 t -113.49 160.25 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.224 1.41 . . . . 0.0 108.788 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.21 172.67 29.25 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 115.39 0.916 . . . . 0.0 115.39 -176.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.2 mt -134.77 113.99 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.902 1.281 . . . . 0.0 109.132 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -75.18 149.03 39.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.91 1.284 . . . . 0.0 110.008 169.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -136.8 139.35 41.71 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.326 1.45 . . . . 0.0 112.638 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.1 p -115.62 -175.49 2.73 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.248 1.819 . . . . 0.0 109.819 169.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.86 -10.37 37.52 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 173.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 94.5 p -146.15 -11.63 0.49 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -172.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -142.45 169.9 16.71 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.208 1.367 . . . . 0.0 112.47 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 35.6 p-90 -123.25 161.76 23.95 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.82 1.648 . . . . 0.0 110.323 171.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -146.71 121.7 10.04 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.176 1.39 . . . . 0.0 110.586 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.2 mm -80.94 138.39 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 95.0 mtp -137.69 144.36 41.75 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.153 0.981 . . . . 0.0 111.388 -171.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.7 m -140.61 166.31 23.95 Favored Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 127.478 2.311 . . . . 0.0 111.176 -169.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.62 167.61 9.69 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.0 2.467 . . . . 0.0 114.162 173.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.86 164.69 31.86 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.434 1.969 . . . . 0.0 110.256 169.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 85.1 tttt 59.38 -52.5 0.06 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 127.909 2.484 . . . . 0.0 115.469 -169.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 t -152.88 142.48 14.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 125.817 1.647 . . . . 0.0 112.208 -172.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -80.17 -16.65 10.92 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.435 2.757 . . . . 0.0 112.532 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 m -82.14 -5.89 58.78 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -169.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -146.95 150.33 34.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.891 1.276 . . . . 0.0 111.664 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -55.35 115.59 2.36 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.774 1.63 . . . . 0.0 112.088 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.3 tpt85 -153.29 154.47 34.67 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.519 1.528 . . . . 0.0 110.1 176.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -137.94 148.62 45.44 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.952 0.901 . . . . 0.0 112.823 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.4 t -150.79 144.44 17.26 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 129.633 3.173 . . . . 0.0 106.791 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -62.92 154.43 66.76 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 CA-C-N 121.795 1.677 . . . . 0.0 111.307 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.6 21.8 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -61.33 -10.22 6.73 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.02 -2.3 . . . . 0.0 114.023 177.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -65.92 -20.72 66.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.327 1.051 . . . . 0.0 113.061 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.87 -12.48 0.56 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -127.28 55.8 1.57 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.731 2.412 . . . . 0.0 108.091 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -39.88 -38.72 0.72 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 117.327 2.343 . . . . 0.0 117.327 -169.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -130.76 18.6 5.14 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.547 1.539 . . . . 0.0 112.033 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -136.85 1.51 2.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.786 1.635 . . . . 0.0 113.024 -170.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.1 p -60.85 -16.28 39.62 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.758 1.623 . . . . 0.0 115.08 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.94 138.92 39.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.357 1.463 . . . . 0.0 111.054 171.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -162.21 -179.99 7.47 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -142.97 166.2 25.29 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.769 2.428 . . . . 0.0 110.574 173.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -136.31 16.32 3.2 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -147.58 171.5 15.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.327 1.051 . . . . 0.0 113.168 -170.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -137.76 14.14 2.92 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.518 1.527 . . . . 0.0 111.715 169.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.47 11.55 0.79 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.979 1.712 . . . . 0.0 114.833 -172.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.4 mt -109.79 160.39 16.38 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.707 1.139 . . . . 0.0 112.879 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 64.5 m -134.79 124.41 25.11 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 127.229 2.212 . . . . 0.0 107.604 169.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -96.42 142.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.675 1.19 . . . . 0.0 109.983 -175.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -139.4 155.31 47.71 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.234 1.813 . . . . 0.0 109.74 175.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.0 mp -139.21 162.24 35.47 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.173 -0.954 . . . . 0.0 112.718 -177.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.17 145.87 14.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 126.144 1.778 . . . . 0.0 110.399 169.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -72.0 -9.58 15.84 Favored 'Cis proline' 0 CA--C 1.544 1.02 0 CA-C-N 120.575 1.241 . . . . 0.0 113.284 -8.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -64.22 173.6 1.92 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.816 1.647 . . . . 0.0 113.141 171.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -127.38 137.71 31.25 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.214 1.405 . . . . 0.0 111.191 -169.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -78.71 59.51 7.28 Favored 'Trans proline' 0 CA--C 1.549 1.254 0 C-N-CA 124.814 3.676 . . . . 0.0 112.097 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -151.43 148.04 27.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.936 1.294 . . . . 0.0 112.429 -173.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -77.85 82.61 4.22 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.352 1.072 . . . . 0.0 113.535 -177.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 64.1 p -68.02 8.6 0.39 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.147 2.179 . . . . 0.0 114.723 169.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.7 m120 60.77 21.39 11.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.664 1.986 . . . . 0.0 114.106 -175.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -145.98 168.26 12.17 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 126.891 2.076 . . . . 0.0 109.672 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.53 149.62 56.06 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 120.931 1.088 . . . . 0.0 111.388 169.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -77.46 -60.26 2.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.19 0.996 . . . . 0.0 109.883 170.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 41.0 t -84.42 142.13 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.278 1.431 . . . . 0.0 109.504 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 75.6 t -131.0 144.27 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 110.863 175.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -126.84 130.88 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.123 2.569 . . . . 0.0 109.342 -169.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.6 mt -94.13 157.05 16.25 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.428 0.632 . . . . 0.0 111.222 169.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.8 -24.36 56.9 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -71.49 -18.54 62.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.979 1.712 . . . . 0.0 113.468 176.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.72 6.0 62.57 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.575 1.083 . . . . 0.0 114.394 -175.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -84.35 142.4 30.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.416 1.108 . . . . 0.0 108.709 169.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -129.27 152.73 37.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 125.882 1.673 . . . . 0.0 110.12 -168.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.4 p -55.49 118.66 19.97 Favored Pre-proline 0 N--CA 1.471 0.6 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.259 169.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -68.42 126.46 14.24 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 121.946 1.764 . . . . 0.0 111.102 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -157.13 173.64 16.68 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.755 1.222 . . . . 0.0 112.951 -175.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -133.62 149.8 51.6 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.778 0.831 . . . . 0.0 111.053 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.1 tp -139.56 120.5 14.52 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.946 2.098 . . . . 0.0 108.364 -173.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -110.28 148.71 31.37 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.953 1.701 . . . . 0.0 110.455 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.6 mtt -126.38 134.29 51.08 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.294 1.438 . . . . 0.0 108.579 176.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -130.15 153.36 48.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.23 1.412 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.85 129.21 39.0 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.675 0.67 . . . . 0.0 110.022 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.56 -16.33 62.46 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -93.18 -53.86 1.82 Allowed Glycine 0 CA--C 1.533 1.189 0 C-N-CA 124.139 0.875 . . . . 0.0 113.101 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 63.1 p -79.03 -26.66 43.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.09 0.945 . . . . 0.0 113.283 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 76.8 3.73 80.52 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.885 1.231 . . . . 0.0 113.563 -169.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.65 131.36 61.19 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.767 1.284 . . . . 0.0 111.759 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.3 144.58 30.08 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.662 2.908 . . . . 0.0 114.273 172.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.71 -43.85 2.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.477 1.911 . . . . 0.0 112.071 -175.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -155.02 156.01 35.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.874 1.67 . . . . 0.0 108.876 -172.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.5 m -141.82 148.24 38.54 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.352 1.061 . . . . 0.0 109.426 171.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 37.0 mt -122.46 140.36 52.82 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.557 2.343 . . . . 0.0 107.64 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.2 t -143.56 130.1 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.71 0.804 . . . . 0.0 111.786 -169.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 36.0 t -117.22 115.12 24.69 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.206 1.403 . . . . 0.0 110.94 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -74.45 -10.01 59.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.447 1.099 . . . . 0.0 113.952 174.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 135.73 -0.65 3.42 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.949 1.262 . . . . 0.0 115.495 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 72.2 m -147.35 151.89 37.29 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.147 1.474 . . . . 0.0 113.301 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -60.34 135.58 91.4 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 125.469 1.508 . . . . 0.0 114.854 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -94.04 167.5 19.98 Favored 'Cis proline' 0 CA--C 1.545 1.073 0 CA-C-N 120.346 1.159 . . . . 0.0 110.398 -11.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . 0.258 0.1 OUTLIER -84.92 158.39 20.58 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.19 -0.944 . . . . 0.0 112.474 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -75.59 174.36 9.82 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.181 2.192 . . . . 0.0 113.78 -169.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -135.5 137.5 42.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.594 1.957 . . . . 0.0 110.34 169.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.8 t -152.93 162.91 40.72 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.897 1.279 . . . . 0.0 111.577 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -88.43 134.01 33.96 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.56 58.87 0.67 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.18 1.792 . . . . 0.0 115.086 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 62.54 11.06 4.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 127.209 2.204 . . . . 0.0 116.909 176.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.98 -29.47 63.28 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -169.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 81.3 p -91.92 -9.62 42.51 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.52 14.59 Favored Pre-proline 0 N--CA 1.478 0.95 0 CA-C-O 116.202 -1.856 . . . . 0.0 115.835 -174.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 C--O 1.25 1.113 0 C-N-CA 123.971 3.114 . . . . 0.0 115.18 176.776 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.791 0.329 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.25 161.82 38.64 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.153 1.381 . . . . 0.0 111.179 177.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -145.72 -2.29 0.75 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.876 1.27 . . . . 0.0 113.197 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.6 28.97 45.43 Favored Glycine 0 CA--C 1.535 1.301 0 O-C-N 121.089 -1.007 . . . . 0.0 112.037 -170.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.4 ttm-85 -144.87 -29.65 0.46 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.405 1.882 . . . . 0.0 112.815 -169.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -49.22 -39.79 31.26 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.271 2.228 . . . . 0.0 115.325 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.61 -39.76 80.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.865 0.757 . . . . 0.0 112.629 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.46 -41.68 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.754 0.822 . . . . 0.0 110.318 176.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -49.31 78.05 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.471 0.709 . . . . 0.0 111.903 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.24 -35.35 78.66 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.306 0.957 . . . . 0.0 112.666 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.4 m -61.95 -53.22 58.73 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.016 0.826 . . . . 0.0 111.219 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -61.17 -33.33 73.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.206 1.002 . . . . 0.0 112.885 177.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.2 90.18 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.379 1.072 . . . . 0.0 113.01 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.3 mtt-85 -63.93 -42.27 97.41 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.966 0.906 . . . . 0.0 110.841 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.8 -46.23 86.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.986 0.914 . . . . 0.0 112.26 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.1 m -59.69 -42.45 93.02 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.923 1.289 . . . . 0.0 111.252 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.71 77.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.346 1.058 . . . . 0.0 113.681 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.15 97.04 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.314 -0.866 . . . . 0.0 111.537 173.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 52.4 tpt85 -64.02 -39.33 93.85 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.324 1.05 . . . . 0.0 112.427 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.82 -43.32 93.48 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.47 1.108 . . . . 0.0 113.022 170.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.1 m -60.11 -43.17 95.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.228 0.611 . . . . 0.0 110.416 176.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.97 94.97 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.069 -1.019 . . . . 0.0 113.49 171.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.7 -36.38 83.46 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.181 -0.949 . . . . 0.0 113.246 176.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.6 tp -71.45 -33.64 69.53 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.418 1.087 . . . . 0.0 111.603 174.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.02 -44.46 96.67 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.055 -1.028 . . . . 0.0 111.334 169.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -45.26 62.78 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.467 1.507 . . . . 0.0 111.74 169.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.7 -45.18 87.7 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 176.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 59.8 mt -61.65 -45.21 99.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.526 1.131 . . . . 0.0 110.831 177.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.02 -27.94 69.23 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.649 1.18 . . . . 0.0 113.271 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -92.78 -30.27 15.57 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.08 -29.92 67.69 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.2 t -77.72 -14.64 59.55 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 173.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.3 mt -106.14 -37.14 6.69 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.302 1.441 . . . . 0.0 113.651 -172.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.4 m -85.6 -7.91 58.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -173.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.17 -1.87 88.48 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 115.384 0.914 . . . . 0.0 115.384 170.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -142.15 148.36 47.87 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 127.167 2.187 . . . . 0.0 107.843 171.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -44.63 152.6 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.721 2.947 . . . . 0.0 113.942 168.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.26 161.84 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.673 1.589 . . . . 0.0 108.105 175.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.14 173.07 34.08 Favored Glycine 0 N--CA 1.465 0.615 0 CA-C-N 120.118 1.326 . . . . 0.0 115.473 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.9 mt -136.62 123.48 31.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 C-N-CA 124.583 1.153 . . . . 0.0 109.18 -177.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -88.92 151.73 22.15 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.882 1.673 . . . . 0.0 110.605 171.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -141.14 144.73 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.179 1.392 . . . . 0.0 112.676 -173.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.4 p -128.03 179.69 5.44 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.772 1.629 . . . . 0.0 110.589 170.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.7 1.45 12.29 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 121.313 -0.867 . . . . 0.0 113.254 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -138.27 -21.21 1.06 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -173.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.33 175.82 12.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.061 1.345 . . . . 0.0 112.144 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 26.7 p90 -139.0 147.8 42.62 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 126.006 1.722 . . . . 0.0 109.069 175.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -141.65 113.59 7.94 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.233 1.413 . . . . 0.0 111.284 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.0 mt -78.57 137.53 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 24.1 mtm -134.07 155.27 50.32 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.977 1.311 . . . . 0.0 110.885 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.4 p -147.18 161.76 35.3 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.654 1.182 . . . . 0.0 110.956 -168.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -59.72 144.03 99.52 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.627 2.218 . . . . 0.0 112.567 169.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -131.44 -13.67 1.85 Allowed Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.574 1.083 . . . . 0.0 115.24 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -158.21 153.45 25.69 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.298 2.239 . . . . 0.0 108.803 174.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . 0.261 15.3 t 33.4 68.06 1.05 Allowed Pre-proline 0 N--CA 1.483 1.196 0 C-N-CA 126.457 1.903 . . . . 0.0 115.999 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -52.41 -24.68 22.32 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.09 2.527 . . . . 0.0 113.949 170.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -57.12 -14.86 4.38 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.879 2.072 . . . . 0.0 115.141 171.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.28 -108.91 0.26 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.374 1.469 . . . . 0.0 111.263 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -154.05 119.59 5.19 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.236 1.414 . . . . 0.0 110.731 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.1 tpt85 -153.52 153.23 32.02 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.505 1.522 . . . . 0.0 110.384 173.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -136.42 147.06 47.07 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.453 1.101 . . . . 0.0 111.486 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -149.04 144.15 17.77 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 126.944 2.098 . . . . 0.0 108.363 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.66 131.75 42.8 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 122.745 2.296 . . . . 0.0 112.683 171.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.9 tp -67.54 99.06 0.72 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.853 1.261 . . . . 0.0 111.098 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -139.97 -7.08 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -171.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.84 -27.59 52.26 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.651 1.18 . . . . 0.0 114.142 -173.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -139.46 31.0 2.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.975 1.71 . . . . 0.0 110.897 169.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -148.61 45.15 1.03 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.849 2.46 . . . . 0.0 109.082 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.2 123.06 8.69 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.956 1.303 . . . . 0.0 112.937 -169.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.1 t70 57.66 11.21 1.22 Allowed 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 -177.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -123.32 26.98 7.7 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.408 -1.432 . . . . 0.0 113.784 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.9 p -62.66 -40.01 95.71 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.093 0.957 . . . . 0.0 112.434 169.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.16 139.96 30.62 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.333 1.053 . . . . 0.0 110.707 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -138.96 157.76 45.43 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -169.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -156.76 53.36 0.52 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.776 2.03 . . . . 0.0 110.037 -169.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 15.8 m0 -60.78 18.3 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.619 2.768 . . . . 0.0 118.358 -169.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -144.91 179.37 7.38 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.375 -1.453 . . . . 0.0 113.671 -173.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -137.23 16.82 2.98 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.51 1.524 . . . . 0.0 112.852 175.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.67 -1.26 0.7 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.8 mt -119.64 163.53 17.24 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.967 1.365 . . . . 0.0 114.436 -169.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.0 t -136.29 129.31 31.27 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 128.237 2.615 . . . . 0.0 106.949 168.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.83 137.59 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.648 1.179 . . . . 0.0 109.61 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -133.24 132.01 40.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.916 1.286 . . . . 0.0 109.58 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -116.85 145.23 43.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.691 1.196 . . . . 0.0 111.846 -169.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -145.45 151.41 47.14 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.476 1.91 . . . . 0.0 110.495 -172.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -75.92 -15.33 24.31 Favored 'Cis proline' 0 CA--C 1.543 0.953 0 CA-C-N 120.244 1.123 . . . . 0.0 112.337 -10.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -64.63 133.82 53.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.652 . . . . 0.0 111.868 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.14 147.51 90.62 Favored Pre-proline 0 CA--C 1.547 0.833 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 176.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -71.42 142.28 40.49 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.723 2.282 . . . . 0.0 109.588 169.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -154.99 -159.21 0.92 Allowed 'General case' 0 CA--C 1.549 0.936 0 O-C-N 121.507 -0.745 . . . . 0.0 112.221 -171.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -143.07 41.79 1.53 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.485 2.714 . . . . 0.0 108.106 168.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 34.9 t -65.9 154.49 39.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.764 2.026 . . . . 0.0 114.214 -169.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -69.98 -9.37 54.95 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 113.316 169.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -126.06 161.13 53.48 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 125.046 1.339 . . . . 0.0 111.548 176.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.51 158.62 43.88 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.376 2.051 . . . . 0.0 112.062 169.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -87.94 -28.93 21.19 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.692 0.797 . . . . 0.0 111.061 169.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -113.21 134.74 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.994 1.317 . . . . 0.0 109.826 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 87.6 t -133.0 140.79 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.408 1.083 . . . . 0.0 110.775 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -118.7 120.23 63.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 127.304 2.241 . . . . 0.0 108.652 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.5 mt -89.21 158.65 17.8 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.129 0.966 . . . . 0.0 111.742 176.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.17 -23.0 53.78 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -106.77 7.39 30.31 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.726 1.211 . . . . 0.0 113.932 -172.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 100.01 12.4 39.96 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 115.559 0.984 . . . . 0.0 115.559 172.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -98.78 140.34 33.11 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.614 1.207 . . . . 0.0 109.848 169.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 2.9 mp -133.76 143.83 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.757 1.623 . . . . 0.0 108.068 -169.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 p -50.16 123.15 15.81 Favored Pre-proline 0 N--CA 1.475 0.779 0 C-N-CA 124.328 1.051 . . . . 0.0 111.613 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.76 123.5 13.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.675 2.25 . . . . 0.0 112.929 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.432 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.2 p90 -152.21 174.24 14.0 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.388 1.475 . . . . 0.0 111.36 176.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 65.7 m -145.94 146.57 31.1 Favored 'General case' 0 C--N 1.33 -0.251 0 O-C-N 121.307 -0.871 . . . . 0.0 111.373 172.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.2 tp -129.2 124.47 34.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 127.641 2.377 . . . . 0.0 108.392 -169.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -120.19 144.86 47.48 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.492 1.117 . . . . 0.0 110.118 -177.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.1 mtt -123.06 129.99 52.2 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 109.629 -178.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.11 138.68 52.62 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.187 1.395 . . . . 0.0 111.088 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -57.92 123.62 16.43 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.989 1.316 . . . . 0.0 111.535 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -17.81 54.92 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -116.82 -45.03 0.56 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.09 1.329 . . . . 0.0 113.943 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.0 m -73.3 -25.65 60.74 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.679 1.239 . . . . 0.0 112.338 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.9 33.35 57.68 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.022 0.82 . . . . 0.0 113.984 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -136.71 139.59 29.55 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.287 1.435 . . . . 0.0 111.375 -169.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -52.14 146.57 30.19 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.942 3.095 . . . . 0.0 114.626 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.07 -8.71 1.02 Allowed 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.0 tp -163.07 152.71 15.42 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.42 1.488 . . . . 0.0 110.308 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 1.1 m -139.71 146.24 39.35 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.642 1.577 . . . . 0.0 108.781 169.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.59 139.17 53.82 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.745 2.418 . . . . 0.0 108.829 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.9 t -137.01 128.44 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.46 0.704 . . . . 0.0 112.328 -170.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.432 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 52.7 t -105.64 109.41 21.36 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.305 1.442 . . . . 0.0 109.977 172.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 63.7 p -74.04 -17.35 60.98 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 143.58 -8.12 2.03 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.068 1.318 . . . . 0.0 115.034 -177.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.5 p -153.99 161.05 42.25 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.214 1.507 . . . . 0.0 113.899 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -61.73 137.89 95.19 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 125.95 1.7 . . . . 0.0 115.533 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -94.64 177.67 10.75 Favored 'Cis proline' 0 CA--C 1.547 1.157 0 CA-C-N 120.032 1.047 . . . . 0.0 110.513 -11.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.32 153.88 41.48 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.073 -1.017 . . . . 0.0 111.757 171.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -88.26 161.39 17.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.372 1.469 . . . . 0.0 109.505 169.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -138.26 140.63 39.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.621 1.568 . . . . 0.0 111.247 -169.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 2.4 t -150.36 157.46 43.07 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.81 2.044 . . . . 0.0 109.703 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -82.57 -12.31 57.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -169.56 65.94 0.05 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.152 1.381 . . . . 0.0 114.044 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.07 12.31 2.37 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 116.904 2.187 . . . . 0.0 116.904 171.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.23 -28.9 69.49 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 120.715 1.598 . . . . 0.0 113.822 -177.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 36.0 p -89.18 3.37 52.15 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.059 1.744 . . . . 0.0 113.743 175.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -115.85 85.15 14.05 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 125.99 1.716 . . . . 0.0 111.399 -170.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--O 1.25 1.091 0 C-N-CA 123.07 2.514 . . . . 0.0 112.093 172.099 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mtp . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.66 12.7 1.54 Allowed 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.0 p90 -154.47 177.84 10.73 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.765 1.626 . . . . 0.0 112.054 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 104.72 8.46 37.19 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.98 1.276 . . . . 0.0 114.456 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 30.2 ptt-85 -150.93 52.68 0.86 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.848 2.059 . . . . 0.0 111.414 -170.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -50.85 -35.25 31.52 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.978 1.311 . . . . 0.0 114.073 -173.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.49 -33.8 75.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 39.0 t -73.58 -44.08 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.843 0.857 . . . . 0.0 110.199 175.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.55 95.75 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 118.772 0.714 . . . . 0.0 111.904 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -56.58 -48.85 76.48 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.072 1.349 . . . . 0.0 112.509 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 176.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -59.09 -40.98 86.96 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.262 -0.875 . . . . 0.0 112.66 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.67 83.69 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.955 1.252 . . . . 0.0 111.886 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -68.32 -39.38 82.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.454 1.102 . . . . 0.0 111.457 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.57 -44.57 90.28 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.121 0.568 . . . . 0.0 112.219 171.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.1 m -60.08 -38.63 83.47 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.866 1.267 . . . . 0.0 111.589 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -44.25 81.0 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 173.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.5 98.64 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 121.349 -0.844 . . . . 0.0 112.034 174.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -60.84 -47.72 85.07 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.834 1.254 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -58.59 -43.39 89.49 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 174.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -57.84 -43.01 85.58 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.06 0.845 . . . . 0.0 111.021 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.32 89.33 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.882 -1.136 . . . . 0.0 113.722 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.84 -31.2 71.66 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.972 -1.08 . . . . 0.0 113.46 176.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 tp -70.23 -35.98 74.22 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.376 1.07 . . . . 0.0 111.498 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.43 -44.73 95.72 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.12 -0.987 . . . . 0.0 111.653 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 tp -53.67 -48.1 69.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.614 1.166 . . . . 0.0 111.393 169.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.84 -38.48 85.63 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.9 mt -64.95 -46.21 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.953 0.901 . . . . 0.0 110.935 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.81 -40.89 89.89 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.8 -0.563 . . . . 0.0 112.115 175.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -67.31 -41.61 85.06 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.464 -0.772 . . . . 0.0 112.398 173.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.07 -38.11 87.57 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.948 1.249 . . . . 0.0 112.605 176.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.38 -24.19 50.63 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.959 -0.463 . . . . 0.0 112.17 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -32.92 17.71 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.08 0.952 . . . . 0.0 113.122 177.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.9 m -79.99 -21.45 43.62 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -169.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.54 8.5 87.61 Favored Glycine 0 CA--C 1.541 1.709 0 CA-C-N 118.82 0.736 . . . . 0.0 114.616 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -144.99 149.06 41.03 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 127.584 2.354 . . . . 0.0 107.595 171.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.06 160.3 0.29 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.485 2.79 . . . . 0.0 113.719 168.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.1 t -127.56 162.24 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 126.629 1.971 . . . . 0.0 109.099 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.58 178.64 28.78 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 115.216 0.846 . . . . 0.0 115.216 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -133.59 116.63 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.793 1.237 . . . . 0.0 109.358 -172.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -85.36 68.46 10.48 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.877 2.071 . . . . 0.0 110.851 -176.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -61.65 153.1 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.716 0.806 . . . . 0.0 113.075 169.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 p -139.37 -177.05 4.75 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.308 2.243 . . . . 0.0 109.77 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -57.76 -21.98 44.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 173.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m -138.39 -4.08 1.68 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -171.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.42 176.17 10.24 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 122.361 1.077 . . . . 0.0 113.409 -176.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -154.55 161.58 41.56 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.821 2.448 . . . . 0.0 108.49 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.7 148.33 1.12 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.741 2.016 . . . . 0.0 109.879 169.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.6 mm -73.29 147.23 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.058 0.543 . . . . 0.0 109.756 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 61.6 mtp -128.65 134.58 48.57 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.094 1.358 . . . . 0.0 108.804 169.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -134.71 160.04 69.91 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 125.39 1.476 . . . . 0.0 109.878 -168.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -63.39 -24.78 71.13 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.25 1.967 . . . . 0.0 115.135 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.91 -52.76 0.05 OUTLIER Glycine 0 CA--C 1.54 1.608 0 C-N-CA 129.219 3.295 . . . . 0.0 116.738 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -144.03 -18.11 0.58 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 128.164 2.586 . . . . 0.0 112.689 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 p -131.1 69.59 82.41 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 125.099 1.36 . . . . 0.0 113.161 -169.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -71.0 27.77 0.21 Allowed 'Trans proline' 0 CA--C 1.55 1.305 0 C-N-CA 124.974 3.783 . . . . 0.0 113.763 173.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 m -71.14 -35.19 71.6 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.073 1.749 . . . . 0.0 113.932 -170.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -173.22 -44.55 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.631 1.572 . . . . 0.0 112.98 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -148.53 -66.76 0.23 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.174 0.99 . . . . 0.0 112.67 -172.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -12.41 87.73 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 129.226 3.01 . . . . 0.0 115.547 -172.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -73.69 161.03 30.71 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 36.0 t -139.72 134.48 16.12 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 128.022 2.529 . . . . 0.0 107.205 170.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -65.04 133.58 36.25 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.049 1.833 . . . . 0.0 110.167 174.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -76.46 82.02 3.17 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.802 0.811 . . . . 0.0 111.075 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -132.21 17.82 4.5 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.325 1.85 . . . . 0.0 112.584 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -58.66 -24.04 60.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.746 1.218 . . . . 0.0 114.088 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -145.43 -33.31 0.36 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.731 1.613 . . . . 0.0 112.36 173.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.9 28.36 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.989 1.715 . . . . 0.0 113.922 169.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.6 -25.55 10.96 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.617 1.967 . . . . 0.0 116.101 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -132.05 18.41 4.55 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.063 1.745 . . . . 0.0 112.603 175.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -136.86 -2.01 2.16 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.505 1.522 . . . . 0.0 113.617 -173.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 79.7 p -65.12 -14.32 60.26 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -176.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -135.11 162.25 33.02 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.752 1.221 . . . . 0.0 113.997 -172.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.289 48.2 t-20 40.75 -114.57 0.21 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.945 2.098 . . . . 0.0 113.434 -168.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.5 t70 56.34 8.07 0.39 Allowed 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 125.906 1.683 . . . . 0.0 114.825 -169.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 49.8 m0 -115.42 -33.76 5.16 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.621 -1.3 . . . . 0.0 112.935 -170.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 169.07 23.32 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -142.03 25.5 1.93 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.987 1.715 . . . . 0.0 111.097 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -143.33 -1.62 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -169.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 52.0 mt -117.06 165.24 13.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -169.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -133.94 131.43 39.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 128.794 2.838 . . . . 0.0 107.341 169.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -103.37 142.47 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 124.817 1.247 . . . . 0.0 109.468 -174.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -139.24 149.38 44.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.581 1.552 . . . . 0.0 109.547 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 83.9 mt -132.42 160.46 36.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.014 0.925 . . . . 0.0 112.727 -171.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.55 142.83 13.11 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.823 1.649 . . . . 0.0 110.029 169.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -73.19 -8.28 18.15 Favored 'Cis proline' 0 CA--C 1.547 1.155 0 CA-C-N 120.419 1.185 . . . . 0.0 113.516 -9.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -64.48 173.68 2.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.133 1.773 . . . . 0.0 112.891 174.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -118.16 134.39 23.36 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.228 1.411 . . . . 0.0 112.224 -175.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -78.59 74.25 5.53 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 124.123 3.215 . . . . 0.0 111.256 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -136.42 144.87 44.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.573 1.149 . . . . 0.0 111.567 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -76.34 56.17 1.05 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.351 1.461 . . . . 0.0 111.627 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.7 p -65.51 -6.46 10.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 128.479 2.712 . . . . 0.0 117.083 -169.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.68 26.08 15.84 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 113.97 -170.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -142.66 165.59 25.78 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 125.546 1.538 . . . . 0.0 109.775 169.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.96 142.74 69.91 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 121.437 1.425 . . . . 0.0 113.226 171.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.31 -13.22 18.91 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.851 2.061 . . . . 0.0 112.297 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -133.36 141.16 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.154 1.782 . . . . 0.0 108.019 173.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.4 t -133.18 144.26 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.487 1.115 . . . . 0.0 110.815 -174.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -130.2 121.16 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 127.948 2.499 . . . . 0.0 108.934 -169.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.5 157.81 31.8 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.988 1.315 . . . . 0.0 111.236 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.79 -7.81 5.69 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -178.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -115.56 8.31 15.09 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.724 1.61 . . . . 0.0 112.989 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.35 8.96 67.66 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 115.321 0.888 . . . . 0.0 115.321 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -78.84 144.4 35.05 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 169.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.3 mm -130.79 126.8 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.289 1.036 . . . . 0.0 108.763 -169.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 79.1 m -57.71 113.16 5.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -178.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -50.74 133.55 39.27 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 124.174 3.25 . . . . 0.0 115.839 -170.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -165.23 176.69 8.19 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.761 2.025 . . . . 0.0 111.4 179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.0 t -141.15 146.15 36.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.633 1.173 . . . . 0.0 109.216 168.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tp -131.11 120.78 23.86 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 126.72 2.008 . . . . 0.0 108.704 -169.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.5 tt -112.11 148.34 34.17 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.485 1.514 . . . . 0.0 110.047 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 70.5 mtm -132.12 137.73 47.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.349 1.06 . . . . 0.0 109.372 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.42 155.89 49.82 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.94 1.696 . . . . 0.0 110.184 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -63.3 132.75 52.61 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 119.009 0.822 . . . . 0.0 110.327 173.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.21 -33.07 67.14 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -175.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.36 -47.44 3.79 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 119.016 0.825 . . . . 0.0 114.314 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.5 p -80.35 -28.05 38.17 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.81 7.57 70.33 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.887 0.756 . . . . 0.0 112.939 -169.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -71.15 128.22 90.65 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.969 1.307 . . . . 0.0 110.494 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.51 149.49 87.66 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.544 2.163 . . . . 0.0 112.008 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.25 -47.95 1.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.808 1.643 . . . . 0.0 111.884 -172.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.3 tt -153.31 149.0 27.43 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.391 1.476 . . . . 0.0 108.799 -169.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.0 m -139.88 143.62 36.79 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.964 0.906 . . . . 0.0 110.085 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.3 mt -122.78 148.0 45.87 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 127.047 2.139 . . . . 0.0 108.675 -178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.7 t -142.84 135.86 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.284 0.634 . . . . 0.0 111.788 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 30.7 t -113.83 151.57 31.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.925 1.29 . . . . 0.0 111.581 176.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -128.64 -0.44 5.49 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.758 1.623 . . . . 0.0 113.787 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.24 -13.1 5.21 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.819 1.199 . . . . 0.0 115.381 176.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.6 t -153.04 156.07 38.06 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.478 1.639 . . . . 0.0 113.48 -174.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -55.98 137.99 72.46 Favored Pre-proline 0 CA--C 1.552 1.047 0 C-N-CA 126.738 2.015 . . . . 0.0 115.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -96.17 178.39 8.69 Favored 'Cis proline' 0 CA--C 1.55 1.283 0 CA-C-N 120.099 1.071 . . . . 0.0 110.793 -11.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.03 159.61 30.43 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.041 -1.037 . . . . 0.0 112.159 169.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -90.8 168.43 11.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.881 1.672 . . . . 0.0 109.902 169.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -143.79 141.88 30.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.254 1.821 . . . . 0.0 111.847 -169.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.2 t -153.72 162.8 40.93 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.275 1.43 . . . . 0.0 111.116 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -84.75 137.12 33.39 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.593 -0.692 . . . . 0.0 109.155 170.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 23.87 65.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 127.556 2.342 . . . . 0.0 116.317 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 58.3 mtm180 57.25 9.67 0.74 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 118.043 2.608 . . . . 0.0 118.043 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -56.78 -20.73 23.94 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.467 1.485 . . . . 0.0 114.948 -175.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.83 12.29 6.23 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.596 1.558 . . . . 0.0 113.052 175.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -74.74 135.27 74.78 Favored Pre-proline 0 N--CA 1.482 1.128 0 O-C-N 120.442 -1.412 . . . . 0.0 110.032 176.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 C--O 1.249 1.069 0 C-N-CA 122.935 2.423 . . . . 0.0 113.318 171.188 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 110.512 -0.181 . . . . 0.0 110.512 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.31 166.49 29.83 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.972 1.309 . . . . 0.0 111.965 178.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.4 p90 -63.04 -28.85 70.38 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.946 1.298 . . . . 0.0 113.988 176.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 167.54 -178.79 41.36 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.17 1.367 . . . . 0.0 112.435 -175.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -145.29 136.02 24.46 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.209 1.403 . . . . 0.0 111.435 176.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -80.39 -26.91 38.31 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -171.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -67.8 -45.51 74.59 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.889 0.875 . . . . 0.0 112.602 -176.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.8 t -63.59 -46.03 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.564 0.745 . . . . 0.0 110.44 173.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.06 78.99 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.481 0.582 . . . . 0.0 112.329 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.75 -42.85 97.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.279 0.945 . . . . 0.0 111.992 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -60.62 -46.95 88.35 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.601 1.091 . . . . 0.0 111.402 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -61.31 -36.07 79.12 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.303 -0.856 . . . . 0.0 112.474 172.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.5 88.19 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.68 1.127 . . . . 0.0 112.763 175.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -61.74 -41.28 97.44 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.497 0.719 . . . . 0.0 111.271 178.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -64.73 -52.74 55.5 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.018 0.527 . . . . 0.0 111.945 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.5 m -52.82 -41.02 63.81 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.382 1.473 . . . . 0.0 111.559 177.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.72 -48.22 69.9 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.711 1.205 . . . . 0.0 113.593 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.93 -42.46 94.01 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.663 0.665 . . . . 0.0 112.34 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -68.52 -38.01 80.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.165 0.586 . . . . 0.0 111.226 175.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -58.71 -43.85 90.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.055 -0.974 . . . . 0.0 112.724 172.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -44.31 83.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.642 1.564 . . . . 0.0 111.988 173.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.05 -39.7 94.65 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.349 0.977 . . . . 0.0 113.099 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.96 78.57 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.089 0.956 . . . . 0.0 113.25 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.54 -36.9 71.14 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 0.0 111.359 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.52 -44.27 96.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.963 -1.085 . . . . 0.0 111.533 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.0 tp -53.07 -45.92 68.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.198 1.399 . . . . 0.0 111.419 169.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.23 -42.04 98.95 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 176.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 75.2 mt -61.89 -47.14 94.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.877 0.871 . . . . 0.0 110.528 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.82 -34.08 75.3 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.867 0.867 . . . . 0.0 113.019 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.0 ttt85 -79.05 -35.05 43.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.667 0.787 . . . . 0.0 113.023 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.34 -25.1 67.71 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -176.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.0 t -77.55 -14.29 59.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 171.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 76.8 mt -108.01 -30.88 8.21 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.009 1.723 . . . . 0.0 113.09 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.8 p -69.23 -29.79 67.81 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.548 1.939 . . . . 0.0 115.088 -176.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.99 83.04 Favored Glycine 0 CA--C 1.542 1.729 0 C-N-CA 124.895 1.236 . . . . 0.0 114.875 -176.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -145.42 145.76 27.45 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 127.247 2.219 . . . . 0.0 107.985 171.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -40.73 139.01 1.38 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.275 2.65 . . . . 0.0 112.955 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.5 t -91.13 162.7 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.47 1.508 . . . . 0.0 108.786 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -146.82 169.41 27.95 Favored Glycine 0 CA--C 1.521 0.447 0 O-C-N 120.914 -1.116 . . . . 0.0 114.637 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.7 mt -136.06 116.6 18.08 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 125.001 1.32 . . . . 0.0 107.5 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -78.6 153.61 30.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.958 1.303 . . . . 0.0 110.688 170.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -141.2 142.54 33.98 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.254 1.822 . . . . 0.0 111.303 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 t -144.34 175.53 10.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.997 1.719 . . . . 0.0 111.26 -176.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -49.07 -29.77 5.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.501 1.921 . . . . 0.0 115.816 -169.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 82.4 p -140.97 14.62 2.27 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.023 1.329 . . . . 0.0 113.586 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.08 171.66 17.52 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.759 1.266 . . . . 0.0 114.355 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -138.28 160.26 39.93 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 127.771 2.428 . . . . 0.0 107.868 169.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -154.19 125.5 7.42 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.797 1.239 . . . . 0.0 110.885 -176.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 16.9 mm -72.82 142.42 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.207 -178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -137.15 151.2 48.54 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.801 1.241 . . . . 0.0 112.25 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -145.45 167.94 13.18 Favored Pre-proline 0 N--CA 1.478 0.948 0 C-N-CA 126.248 1.819 . . . . 0.0 111.277 -169.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -60.79 -23.82 77.46 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.184 2.589 . . . . 0.0 115.866 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.12 -145.32 49.05 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 121.631 -0.668 . . . . 0.0 111.858 -169.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -73.21 1.15 9.88 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 116.635 2.087 . . . . 0.0 116.635 -174.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.6 p -125.47 38.73 0.42 Allowed Pre-proline 0 N--CA 1.485 1.309 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -61.56 -15.07 39.1 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.098 2.532 . . . . 0.0 115.282 -169.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -60.88 -15.21 28.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.455 1.502 . . . . 0.0 114.45 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -145.03 166.91 23.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.901 1.68 . . . . 0.0 111.9 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -63.62 117.91 7.48 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.052 0.941 . . . . 0.0 111.897 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -154.05 160.11 41.85 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.651 1.58 . . . . 0.0 110.528 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -139.79 142.92 36.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.665 1.186 . . . . 0.0 112.52 174.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -150.83 145.14 17.92 Favored Pre-proline 0 N--CA 1.47 0.561 0 C-N-CA 126.099 1.759 . . . . 0.0 109.126 169.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.22 147.18 36.51 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.511 2.141 . . . . 0.0 111.794 169.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.68 12.72 0.12 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -178.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -61.62 -18.41 59.33 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.175 -1.578 . . . . 0.0 113.698 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.44 -18.85 65.64 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -145.83 -16.07 0.47 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -120.43 13.58 11.84 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.04 1.336 . . . . 0.0 112.264 169.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 53.41 -168.64 0.06 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.636 2.375 . . . . 0.0 114.443 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -55.47 -16.6 3.92 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.291 -1.505 . . . . 0.0 113.967 173.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.35 3.15 9.57 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.754 2.021 . . . . 0.0 113.858 174.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -62.54 16.74 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.793 2.037 . . . . 0.0 115.367 174.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -146.73 175.18 10.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.005 1.722 . . . . 0.0 114.305 -169.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -51.48 134.2 29.18 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -173.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -150.87 16.67 0.77 Allowed 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 127.116 2.166 . . . . 0.0 111.44 169.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -88.83 -9.36 51.99 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 -169.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.7 171.79 13.58 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -136.53 9.52 3.15 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.374 1.87 . . . . 0.0 112.301 175.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -157.15 15.8 0.27 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -169.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 68.7 mt -110.66 152.96 25.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.251 -1.531 . . . . 0.0 114.102 -177.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.7 t -131.23 134.94 46.93 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.769 2.827 . . . . 0.0 106.779 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -112.12 139.07 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 125.311 1.445 . . . . 0.0 110.323 -169.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -139.14 123.31 18.0 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.163 1.385 . . . . 0.0 110.747 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.8 mp -106.25 157.22 17.75 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.33 1.062 . . . . 0.0 112.739 -177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.92 126.66 7.27 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.775 2.03 . . . . 0.0 108.846 -174.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -75.99 -9.28 27.14 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.333 1.155 . . . . 0.0 113.605 -8.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -70.29 152.15 44.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.248 1.419 . . . . 0.0 113.972 -170.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.54 120.94 80.51 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.249 1.42 . . . . 0.0 113.453 179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -79.68 63.12 8.7 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.3 3.333 . . . . 0.0 111.098 170.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -157.86 154.19 27.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.0 1.72 . . . . 0.0 110.515 -174.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -56.26 66.18 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.837 2.855 . . . . 0.0 116.925 -173.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.9 t -62.9 158.33 19.35 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.851 2.06 . . . . 0.0 113.479 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -71.07 -7.01 43.52 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.168 1.387 . . . . 0.0 113.46 171.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -136.44 161.76 60.25 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.748 1.619 . . . . 0.0 111.449 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.71 142.86 44.76 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 121.628 1.552 . . . . 0.0 110.17 168.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -72.44 -22.55 61.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.471 1.109 . . . . 0.0 112.31 174.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.5 t -123.17 135.46 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.031 1.333 . . . . 0.0 109.989 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 91.9 t -131.03 144.14 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.584 1.154 . . . . 0.0 110.526 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.3 mp -128.54 123.53 59.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 127.5 2.32 . . . . 0.0 110.184 -169.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.8 mt -83.16 160.82 21.75 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.082 0.944 . . . . 0.0 112.368 175.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.14 62.81 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.899 1.279 . . . . 0.0 113.604 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -93.72 16.17 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.201 1.801 . . . . 0.0 112.555 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 68.97 11.62 63.67 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.658 -1.276 . . . . 0.0 115.279 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.69 143.66 34.4 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.7 mm -132.84 143.41 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.193 1.397 . . . . 0.0 108.847 -171.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.1 p -53.07 127.84 46.83 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.252 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.63 127.55 12.53 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.356 2.038 . . . . 0.0 111.344 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.502 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.2 p90 -160.31 173.76 15.2 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.236 2.214 . . . . 0.0 110.433 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.2 m -135.2 145.88 48.13 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.69 0.796 . . . . 0.0 110.894 169.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -135.52 113.8 11.47 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.692 1.997 . . . . 0.0 108.997 -169.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.7 tt -104.53 146.16 29.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.611 1.564 . . . . 0.0 110.159 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.8 mtt -119.11 133.39 55.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.955 1.302 . . . . 0.0 109.595 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -131.14 139.95 49.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.513 1.525 . . . . 0.0 111.001 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 34.8 t-20 -57.35 119.44 6.47 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.127 1.371 . . . . 0.0 111.259 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.22 -17.63 58.83 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.86 -47.21 0.91 Allowed Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.657 1.122 . . . . 0.0 113.395 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.8 m -76.63 -23.63 53.36 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.978 0.911 . . . . 0.0 112.916 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 71.08 37.0 64.13 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.41 1.005 . . . . 0.0 113.858 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -137.83 136.5 20.0 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 125.203 1.401 . . . . 0.0 111.364 -169.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -53.49 149.51 30.47 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.156 3.238 . . . . 0.0 115.184 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.65 -10.72 0.81 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 176.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -167.68 157.14 10.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.459 1.904 . . . . 0.0 109.336 178.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 19.5 m -145.81 150.19 35.73 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.759 1.224 . . . . 0.0 109.114 169.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.33 138.09 54.63 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 127.369 2.268 . . . . 0.0 108.569 -178.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.0 t -134.72 136.58 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.032 0.933 . . . . 0.0 111.322 -169.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.502 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 36.9 t -120.73 149.6 42.27 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.023 1.729 . . . . 0.0 111.337 177.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.3 p -130.06 0.77 4.73 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.432 1.493 . . . . 0.0 114.276 -177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 136.52 -11.43 4.04 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.456 1.027 . . . . 0.0 115.46 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 89.3 p -156.62 160.29 39.26 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 119.039 1.42 . . . . 0.0 114.022 -172.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 48.7 t-105 -57.39 137.72 81.34 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.832 1.653 . . . . 0.0 114.759 177.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -98.51 176.36 7.94 Favored 'Cis proline' 0 CA--C 1.549 1.232 0 CA-C-N 120.155 1.091 . . . . 0.0 111.376 -10.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.9 mp -71.35 165.13 24.38 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.168 -0.957 . . . . 0.0 110.823 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -120.33 135.48 55.0 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.15 1.38 . . . . 0.0 111.663 -176.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -88.49 149.91 23.4 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.173 1.389 . . . . 0.0 112.054 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.1 t -153.59 170.42 20.86 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.386 1.874 . . . . 0.0 110.66 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.8 mp -101.43 136.77 40.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.111 0.964 . . . . 0.0 108.83 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 35.94 54.82 0.96 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.339 1.856 . . . . 0.0 114.81 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 51.2 ptt85 43.52 33.82 0.7 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.106 2.563 . . . . 0.0 117.015 -177.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.28 -31.5 67.53 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 59.7 p -79.7 -5.18 54.67 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 172.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -137.4 75.76 44.79 Favored Pre-proline 0 N--CA 1.476 0.833 0 C-N-CA 125.614 1.566 . . . . 0.0 112.311 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo . . . . . 0 C--O 1.25 1.115 0 C-N-CA 124.661 3.574 . . . . 0.0 114.293 169.628 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttm . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 110.528 -0.175 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.31 167.05 23.37 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.183 1.393 . . . . 0.0 111.51 178.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -131.59 5.92 4.37 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -169.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.8 50.8 3.35 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 126.236 1.874 . . . . 0.0 114.819 -172.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -132.2 56.46 1.83 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.003 1.721 . . . . 0.0 110.918 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.66 -33.5 4.3 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.285 1.434 . . . . 0.0 114.113 170.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.37 -48.93 65.29 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.934 1.694 . . . . 0.0 113.804 171.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.4 t -73.72 -45.84 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-O 118.6 -0.714 . . . . 0.0 109.948 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.21 -44.38 83.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.607 1.094 . . . . 0.0 112.673 -178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -62.49 -44.25 96.83 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.082 -1.011 . . . . 0.0 111.93 174.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.53 -50.5 72.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.012 0.525 . . . . 0.0 111.111 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -62.54 -37.44 86.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.193 0.997 . . . . 0.0 112.61 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.01 -46.47 89.37 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.128 0.876 . . . . 0.0 111.333 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.74 -37.41 82.12 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.487 1.115 . . . . 0.0 111.885 -178.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -66.08 -46.9 76.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.427 0.691 . . . . 0.0 112.442 171.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 62.7 m -63.07 -35.72 81.18 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.364 1.065 . . . . 0.0 111.281 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.53 79.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.128 1.371 . . . . 0.0 113.685 172.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.83 99.3 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.349 -0.844 . . . . 0.0 111.44 172.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -63.24 -42.55 99.23 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.583 0.753 . . . . 0.0 112.326 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -60.84 -42.31 97.52 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.888 0.767 . . . . 0.0 112.397 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.0 m -60.61 -44.2 96.56 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.419 0.688 . . . . 0.0 110.723 176.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.93 -1.106 . . . . 0.0 113.418 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.61 78.8 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.179 -0.951 . . . . 0.0 112.927 175.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.6 tp -71.3 -34.68 70.83 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.701 1.2 . . . . 0.0 112.038 172.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.1 -44.36 95.92 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.911 -1.118 . . . . 0.0 111.581 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.5 -44.7 62.59 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.438 1.495 . . . . 0.0 111.592 169.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.68 -42.99 97.97 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.46 -44.45 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 119.146 0.884 . . . . 0.0 110.758 175.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.21 -14.94 29.25 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.979 1.312 . . . . 0.0 113.795 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -112.09 -25.66 9.23 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 176.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.2 -29.6 69.92 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.062 1.301 . . . . 0.0 112.748 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -68.52 -19.15 64.5 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 173.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 pp -117.45 -24.67 7.26 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -169.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.8 m -86.22 -12.92 48.39 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.81 1.82 89.83 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.185 0.834 . . . . 0.0 115.185 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -146.8 148.76 34.15 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 127.733 2.413 . . . . 0.0 107.424 171.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -44.96 147.58 1.91 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.078 2.519 . . . . 0.0 112.868 168.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.8 t -104.48 165.23 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 126.144 1.778 . . . . 0.0 108.411 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.28 176.25 30.62 Favored Glycine 0 CA--C 1.522 0.483 0 O-C-N 120.629 -1.295 . . . . 0.0 115.479 -177.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.4 mt -133.81 121.04 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 125.145 1.378 . . . . 0.0 108.256 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -86.29 148.39 25.64 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.791 1.236 . . . . 0.0 110.482 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -134.84 149.0 50.28 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.88 1.672 . . . . 0.0 112.682 -176.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.6 t -146.0 -179.02 6.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.619 2.368 . . . . 0.0 110.105 177.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -58.22 -30.42 66.47 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 -169.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.8 m -138.48 4.54 2.4 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.823 1.249 . . . . 0.0 113.801 -179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.22 168.72 24.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.072 -1.017 . . . . 0.0 112.959 -173.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 17.8 p90 -157.06 161.85 39.48 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.737 2.015 . . . . 0.0 109.397 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 47.1 ttm-85 -155.04 145.95 22.54 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.103 1.361 . . . . 0.0 110.755 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.1 mm -64.17 146.24 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.48 1.112 . . . . 0.0 110.746 171.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 93.9 mtp -135.19 150.85 50.2 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.884 1.674 . . . . 0.0 110.701 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.7 m -142.16 161.81 48.76 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 125.82 1.648 . . . . 0.0 111.387 -170.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.03 -13.11 25.77 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.023 3.148 . . . . 0.0 116.926 -178.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 35.41 -96.83 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 C-N-CA 127.28 2.371 . . . . 0.0 116.287 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 mmmt -68.15 -29.01 67.81 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -168.57 123.4 0.76 Allowed Pre-proline 0 N--CA 1.477 0.88 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -77.15 -20.76 12.57 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.529 2.819 . . . . 0.0 112.25 169.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 t -76.25 -28.79 57.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.749 1.219 . . . . 0.0 112.796 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -130.99 17.23 5.1 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.9 t-105 60.82 76.51 0.37 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.726 2.01 . . . . 0.0 113.425 169.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.94 59.67 1.67 Allowed 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.928 -1.107 . . . . 0.0 112.667 -177.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -44.49 149.4 0.39 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.503 1.921 . . . . 0.0 115.509 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.0 m -142.02 157.15 64.59 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 126.125 1.77 . . . . 0.0 111.163 170.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.56 129.05 21.45 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.815 2.343 . . . . 0.0 109.967 169.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 57.4 tp -74.63 113.11 11.51 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.82 -0.55 . . . . 0.0 109.896 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -138.22 2.5 2.31 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.079 0.952 . . . . 0.0 112.628 169.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.75 -31.2 25.68 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.605 1.962 . . . . 0.0 115.616 -169.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -136.02 26.54 3.27 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.128 1.371 . . . . 0.0 112.029 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -130.27 -12.9 3.99 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.359 1.464 . . . . 0.0 113.222 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.03 -52.92 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 129.717 3.207 . . . . 0.0 114.846 -170.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -152.11 -14.21 0.18 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.723 2.409 . . . . 0.0 113.636 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.94 -1.25 3.8 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.276 -1.515 . . . . 0.0 114.19 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 97.2 p -67.93 -16.33 64.02 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.732 1.613 . . . . 0.0 114.133 170.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -84.49 -173.31 4.65 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -68.75 -119.4 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 125.493 1.517 . . . . 0.0 114.345 175.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.8 t70 60.6 16.78 6.83 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 125.758 1.623 . . . . 0.0 112.623 -167.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 30.8 m0 -77.1 -15.1 59.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.774 1.63 . . . . 0.0 113.348 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -141.32 166.64 24.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.538 1.535 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.68 -33.21 0.26 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.688 2.395 . . . . 0.0 112.116 -176.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -87.92 1.4 54.16 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.028 1.331 . . . . 0.0 113.336 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.9 mt -120.55 166.47 13.58 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 122.979 1.371 . . . . 0.0 114.635 -170.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.5 t -145.13 139.98 27.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 129.244 3.018 . . . . 0.0 106.892 169.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -117.43 146.6 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.163 0.985 . . . . 0.0 111.262 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -139.07 157.34 46.15 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.186 1.794 . . . . 0.0 109.88 175.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.24 170.54 18.73 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 172.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -160.31 161.8 24.86 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 127.819 2.447 . . . . 0.0 109.972 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.86 -15.89 5.48 Favored 'Cis proline' 0 CA--C 1.54 0.775 0 CA-C-N 121.442 1.551 . . . . 0.0 115.65 -10.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -65.43 -176.06 0.3 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.054 1.342 . . . . 0.0 112.692 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.09 147.2 57.73 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.151 0.98 . . . . 0.0 113.071 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -76.13 90.74 1.15 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.941 3.094 . . . . 0.0 110.891 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -155.42 162.31 40.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.222 1.409 . . . . 0.0 111.478 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -74.19 54.42 0.55 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.816 2.047 . . . . 0.0 114.076 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.2 m -58.65 157.01 9.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.308 1.443 . . . . 0.0 113.509 177.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -75.17 2.16 11.55 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -149.61 163.35 25.25 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 127.201 2.2 . . . . 0.0 109.652 179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -65.66 143.13 73.44 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 121.268 1.312 . . . . 0.0 109.564 168.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -73.97 -47.39 37.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.704 -0.622 . . . . 0.0 111.287 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.9 t -83.29 135.17 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.254 1.022 . . . . 0.0 109.314 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 93.8 t -134.98 144.73 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 123.777 0.831 . . . . 0.0 111.15 -178.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.01 118.89 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.034 2.534 . . . . 0.0 109.411 -169.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.6 mt -78.61 161.51 26.92 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.081 0.943 . . . . 0.0 111.692 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.48 -27.39 66.08 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.005 1.322 . . . . 0.0 113.976 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -85.85 -8.14 58.27 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.091 1.756 . . . . 0.0 113.528 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.31 7.45 60.68 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.261 0.934 . . . . 0.0 114.669 -176.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -74.19 138.54 43.83 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.546 1.173 . . . . 0.0 108.502 169.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.1 mm -129.2 150.54 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.008 1.323 . . . . 0.0 109.235 -171.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.0 p -49.22 120.71 10.26 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 124.336 1.054 . . . . 0.0 111.778 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.16 84.44 1.51 Allowed 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.445 2.763 . . . . 0.0 111.71 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -122.01 -179.52 4.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.218 1.807 . . . . 0.0 111.878 -178.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 m -142.29 144.51 33.3 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.142 -0.974 . . . . 0.0 112.165 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.87 144.84 48.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 128.815 2.846 . . . . 0.0 108.78 -175.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -135.6 146.75 48.25 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.373 1.469 . . . . 0.0 110.688 -178.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 56.3 mtt -123.55 131.58 53.67 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 110.005 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.79 145.3 50.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.23 1.812 . . . . 0.0 110.932 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -52.99 129.75 31.57 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.531 1.132 . . . . 0.0 110.302 172.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.4 -18.32 17.17 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.377 1.992 . . . . 0.0 116.377 -174.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.4 -37.89 0.47 Allowed Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.749 -1.028 . . . . 0.0 115.222 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 48.5 p -77.72 -26.05 49.77 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.793 1.796 . . . . 0.0 112.523 171.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.24 5.19 75.98 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.78 1.181 . . . . 0.0 114.104 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.66 124.34 90.65 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.002 1.321 . . . . 0.0 111.451 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.31 142.96 78.17 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.328 2.685 . . . . 0.0 113.292 170.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.69 -35.05 4.04 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.088 0.955 . . . . 0.0 111.555 172.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.8 tp -151.47 153.78 35.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.539 1.136 . . . . 0.0 111.055 -169.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.9 m -142.79 144.72 32.7 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 125.739 1.615 . . . . 0.0 108.814 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.3 mp -124.01 137.57 54.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.599 1.96 . . . . 0.0 108.759 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.2 t -134.49 138.39 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.124 0.97 . . . . 0.0 111.113 -169.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.8 t -116.18 117.61 30.53 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.494 1.118 . . . . 0.0 111.552 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -76.31 -8.13 56.45 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 122.19 0.94 10.46 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.481 1.515 . . . . 0.0 114.376 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 82.5 p -156.92 159.39 38.06 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.174 -1.192 . . . . 0.0 113.412 -173.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -62.51 138.43 96.54 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.997 1.719 . . . . 0.0 115.074 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -94.84 174.55 13.49 Favored 'Cis proline' 0 CA--C 1.546 1.097 0 CA-C-N 119.947 1.017 . . . . 0.0 110.812 -11.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.96 153.75 43.06 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 122.269 1.033 . . . . 0.0 110.889 169.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -100.99 116.1 32.04 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.694 1.598 . . . . 0.0 110.752 -177.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.22 145.42 37.6 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.401 1.081 . . . . 0.0 111.291 176.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.8 t -147.47 148.3 31.1 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.957 1.703 . . . . 0.0 110.588 169.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -72.19 132.59 44.33 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.46 -0.775 . . . . 0.0 109.434 170.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.01 66.02 0.06 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.294 2.237 . . . . 0.0 115.836 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 32.7 mtm105 56.34 21.89 5.84 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.31 -27.39 67.28 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.978 1.717 . . . . 0.0 114.791 -177.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 69.4 p -101.52 7.2 42.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.817 1.247 . . . . 0.0 113.792 169.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 19.1 tpt85 -136.59 45.19 1.16 Allowed Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 126.362 1.865 . . . . 0.0 112.971 -173.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo . . . . . 0 C--O 1.251 1.155 0 C-N-CA 124.031 3.154 . . . . 0.0 114.068 -173.505 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 N--CA 1.471 0.607 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.51 -39.95 81.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.052 1.296 . . . . 0.0 114.493 -169.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 t -65.6 -49.2 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.869 0.868 . . . . 0.0 110.492 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.13 -38.73 88.88 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.572 0.749 . . . . 0.0 112.418 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -62.25 -41.77 98.73 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.095 0.958 . . . . 0.0 111.224 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.5 m -63.48 -48.24 78.48 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.799 -0.563 . . . . 0.0 111.619 173.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.5 mmt-85 -61.69 -32.15 72.33 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.403 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.92 76.75 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.675 1.58 . . . . 0.0 111.848 173.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.0 mtm105 -62.2 -41.15 98.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.641 0.776 . . . . 0.0 111.73 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.11 -49.4 77.45 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -35.66 76.31 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.215 1.006 . . . . 0.0 111.484 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.18 88.11 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.57 97.82 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.084 0.856 . . . . 0.0 111.86 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.0 mtt85 -62.19 -45.57 92.78 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.63 1.172 . . . . 0.0 111.707 176.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -60.78 -44.28 97.0 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.623 0.769 . . . . 0.0 112.653 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.8 m -60.55 -43.42 97.24 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.912 0.778 . . . . 0.0 110.78 178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.83 97.07 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.975 -1.078 . . . . 0.0 113.276 172.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -32.18 73.66 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.275 -0.89 . . . . 0.0 113.115 175.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.3 tp -73.56 -33.72 64.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.204 1.401 . . . . 0.0 111.786 172.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.82 -45.33 93.13 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.892 -1.13 . . . . 0.0 110.704 169.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 tp -52.2 -46.39 65.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.439 1.496 . . . . 0.0 111.324 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.64 96.92 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.81 -45.42 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.708 0.803 . . . . 0.0 110.689 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.06 -35.74 79.56 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.675 0.79 . . . . 0.0 112.815 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.338 1.055 . . . . 0.0 113.164 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.14 -37.88 88.97 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -177.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -70.01 -28.55 65.59 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 121.527 -0.733 . . . . 0.0 112.504 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.3 mt -80.72 -31.99 35.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.081 1.352 . . . . 0.0 112.971 178.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.4 m -82.21 -20.23 38.17 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -170.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.75 3.4 79.46 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -143.03 149.12 47.99 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.127 2.571 . . . . 0.0 107.175 172.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -45.54 143.51 5.89 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.647 2.231 . . . . 0.0 111.807 168.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 25.6 t -88.14 162.5 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.587 1.155 . . . . 0.0 108.716 173.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.93 176.63 23.13 Favored Glycine 0 N--CA 1.46 0.282 0 O-C-N 121.261 -0.9 . . . . 0.0 113.567 173.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.5 mt -137.3 117.18 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.672 1.189 . . . . 0.0 108.813 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -74.77 146.87 41.77 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.239 1.816 . . . . 0.0 110.473 170.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -145.17 133.99 22.36 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.403 1.481 . . . . 0.0 110.351 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -150.74 27.17 0.72 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.057 1.343 . . . . 0.0 113.442 -173.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.8 t0 63.08 -66.97 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 128.242 2.617 . . . . 0.0 113.867 -176.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 75.2 m -66.54 -24.34 66.36 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.909 0.884 . . . . 0.0 113.162 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.05 169.79 21.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.559 1.144 . . . . 0.0 112.048 174.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.5 p90 -153.98 164.41 38.47 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.596 2.758 . . . . 0.0 107.469 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -167.09 146.8 5.37 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.615 1.098 . . . . 0.0 112.713 172.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mm -66.29 152.89 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.473 0.709 . . . . 0.0 109.175 170.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.1 mtp -142.94 151.29 40.79 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.635 1.574 . . . . 0.0 111.96 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.66 164.0 37.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.432 1.893 . . . . 0.0 111.521 -169.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -63.15 167.7 12.1 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.753 2.302 . . . . 0.0 113.47 171.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -156.98 163.27 32.21 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.888 1.709 . . . . 0.0 110.67 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm 59.05 -44.46 0.07 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 128.303 2.641 . . . . 0.0 115.885 -169.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.8 t -155.08 141.63 13.26 Favored Pre-proline 0 N--CA 1.472 0.656 0 C-N-CA 125.794 1.637 . . . . 0.0 111.797 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -79.8 -16.93 11.26 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 C-N-CA 123.188 2.592 . . . . 0.0 112.442 169.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.8 m -77.66 -7.03 55.83 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -169.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.38 151.62 36.81 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.014 1.325 . . . . 0.0 111.48 178.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.3 t-105 -52.69 112.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.946 1.699 . . . . 0.0 112.452 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -152.78 157.42 40.77 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.518 1.527 . . . . 0.0 110.221 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -143.15 143.7 31.91 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -174.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -145.41 139.71 15.21 Favored Pre-proline 0 N--CA 1.472 0.639 0 C-N-CA 128.73 2.812 . . . . 0.0 107.717 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.45 130.83 24.67 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.521 2.147 . . . . 0.0 111.635 174.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -79.3 78.08 5.8 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.796 0.839 . . . . 0.0 110.914 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -136.08 25.98 3.27 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.375 1.47 . . . . 0.0 112.133 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -58.71 -25.04 62.49 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 171.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -149.95 -26.8 0.25 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.108 1.363 . . . . 0.0 113.779 169.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.95 24.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 125.411 1.484 . . . . 0.0 114.193 169.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.36 121.15 8.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.562 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 55.13 22.84 4.84 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -173.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -119.32 -30.71 4.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.484 1.514 . . . . 0.0 110.686 169.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.9 t -67.9 -21.14 65.16 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.979 1.712 . . . . 0.0 112.308 169.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -137.4 152.79 50.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.217 1.407 . . . . 0.0 114.54 -169.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 46.95 -34.58 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.179 1 C-N-CA 131.974 4.11 . . . . 0.0 120.882 169.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.76 -15.62 63.02 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -169.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -68.43 -15.07 63.42 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -146.53 171.09 15.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.374 1.07 . . . . 0.0 113.696 -176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -142.9 17.87 1.96 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.746 1.618 . . . . 0.0 112.582 172.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -144.53 0.59 1.01 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -168.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.8 mt -121.88 161.27 23.1 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -168.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.3 m -130.61 136.26 48.68 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.991 2.916 . . . . 0.0 106.685 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.93 141.53 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 125.01 1.324 . . . . 0.0 110.516 -169.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -139.08 153.42 48.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.52 1.528 . . . . 0.0 109.29 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.57 171.07 16.72 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 172.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.33 154.97 28.3 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 127.634 2.374 . . . . 0.0 109.707 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.94 -10.93 27.07 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 CA-C-N 121.368 1.524 . . . . 0.0 114.633 0.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -67.84 -171.43 0.21 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.27 1.428 . . . . 0.0 110.988 169.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.3 147.44 43.56 Favored Pre-proline 0 N--CA 1.479 0.976 0 O-C-N 120.787 -1.195 . . . . 0.0 112.82 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.1 105.23 1.15 Allowed 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.12 2.546 . . . . 0.0 109.543 174.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -160.98 137.87 8.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.885 1.274 . . . . 0.0 111.306 -169.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -69.78 46.6 0.07 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.355 2.662 . . . . 0.0 114.313 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.3 t -63.25 158.97 18.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.37 1.868 . . . . 0.0 114.159 -176.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -71.25 -5.09 29.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.974 1.31 . . . . 0.0 113.41 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -131.11 164.2 43.89 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 125.794 1.638 . . . . 0.0 111.321 176.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.02 162.12 36.78 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.45 2.1 . . . . 0.0 112.472 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -99.12 -12.22 20.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.12 1.368 . . . . 0.0 112.78 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.3 t -132.26 148.81 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 126.206 1.802 . . . . 0.0 109.398 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 73.0 t -135.49 143.09 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.77 1.228 . . . . 0.0 111.392 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -129.45 126.58 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 128.795 2.838 . . . . 0.0 109.91 -169.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.0 mt -83.98 159.81 21.16 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.123 0.963 . . . . 0.0 112.092 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.87 -26.58 67.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.2 1.4 . . . . 0.0 113.939 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -82.3 -8.6 59.64 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.651 1.58 . . . . 0.0 113.335 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.63 5.72 62.92 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.506 1.051 . . . . 0.0 114.735 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -72.01 138.83 48.23 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.507 1.154 . . . . 0.0 108.962 169.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 6.9 mm -128.05 132.9 68.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 124.558 1.143 . . . . 0.0 109.422 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.3 m -61.02 118.63 37.62 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.261 1.424 . . . . 0.0 110.431 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -52.07 132.7 44.16 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 124.017 3.144 . . . . 0.0 115.294 -176.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.432 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 8.7 p90 -162.72 174.66 12.22 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.525 1.93 . . . . 0.0 111.667 175.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.6 m -137.01 139.95 41.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.622 1.169 . . . . 0.0 109.463 169.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.2 tp -131.66 122.42 25.95 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.857 2.063 . . . . 0.0 109.01 -169.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.4 tt -118.78 144.58 46.2 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.265 1.826 . . . . 0.0 110.995 -169.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.1 mtt -123.54 128.3 49.55 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.093 1.357 . . . . 0.0 110.868 -176.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.16 139.13 54.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.071 1.349 . . . . 0.0 111.458 -178.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.516 ' HB2' HD11 ' A' ' 121' ' ' LEU . 42.5 t-20 -64.18 113.57 3.64 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.795 1.638 . . . . 0.0 110.893 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.59 -18.02 50.2 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -87.17 -17.23 59.49 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.721 1.153 . . . . 0.0 114.825 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.8 p -135.97 -28.74 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.171 1.485 . . . . 0.0 114.159 -169.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 89.64 -3.34 83.34 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.818 1.675 . . . . 0.0 113.885 -173.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -79.17 137.22 56.69 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 118.831 1.316 . . . . 0.0 112.496 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.96 142.4 42.55 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.898 2.399 . . . . 0.0 111.685 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 114' ' ' ASN . 0.2 OUTLIER -113.88 -35.18 5.2 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.717 0.807 . . . . 0.0 112.266 177.631 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.3 tp -155.74 151.55 27.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.257 1.023 . . . . 0.0 111.178 -168.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 75.6 m -139.83 152.83 46.83 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.506 1.122 . . . . 0.0 109.172 169.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.6 mt -124.66 142.53 51.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.681 2.392 . . . . 0.0 108.351 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 34.1 t -135.2 136.24 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.73 0.812 . . . . 0.0 111.969 -169.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.432 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.1 t -124.67 135.13 52.79 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.266 1.826 . . . . 0.0 110.919 -179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.1 m -131.09 7.65 4.67 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.384 1.074 . . . . 0.0 113.824 -176.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 144.73 -18.31 2.01 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.389 1.316 . . . . 0.0 116.389 172.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.3 t -157.36 155.79 31.2 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.786 1.793 . . . . 0.0 113.623 -172.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -58.59 141.8 83.75 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 115.589 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -93.18 178.34 11.88 Favored 'Cis proline' 0 CA--C 1.547 1.173 0 CA-C-N 119.757 0.949 . . . . 0.0 110.769 -11.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.89 155.77 38.65 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.107 -0.996 . . . . 0.0 111.801 169.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.07 119.81 37.36 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.231 1.412 . . . . 0.0 110.867 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -81.98 143.26 31.73 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.57 1.548 . . . . 0.0 111.323 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 3.4 t -142.75 145.01 32.87 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.013 1.325 . . . . 0.0 111.306 175.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.58 137.06 49.73 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 169.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 40.36 -97.98 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.125 1.77 . . . . 0.0 113.314 -169.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -135.35 22.18 3.43 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.524 1.53 . . . . 0.0 112.235 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.01 -21.44 21.4 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -169.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 1.2 t -120.8 11.97 11.24 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 73.91 71.34 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 125.117 1.367 . . . . 0.0 111.628 -170.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 C--O 1.251 1.132 0 C-N-CA 124.738 3.625 . . . . 0.0 114.685 175.358 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.627 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.34 -38.75 84.78 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.316 0.962 . . . . 0.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -63.86 -46.21 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.875 0.87 . . . . 0.0 110.679 173.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -41.75 97.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.36 0.527 . . . . 0.0 112.231 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -63.3 -44.98 93.45 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.398 0.999 . . . . 0.0 111.913 173.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -58.42 -53.04 62.81 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.308 0.643 . . . . 0.0 110.807 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.4 mmp_? -62.0 -32.96 73.48 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.299 1.039 . . . . 0.0 113.049 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.69 -50.98 69.0 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.186 1.357 . . . . 0.0 111.42 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -67.06 -36.06 81.2 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.803 -0.561 . . . . 0.0 111.455 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -63.48 -44.69 93.69 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 169.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.4 m -58.22 -41.17 83.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.361 -0.837 . . . . 0.0 111.075 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.91 -40.48 91.51 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.26 97.63 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.349 0.977 . . . . 0.0 111.954 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -62.63 -44.09 97.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.932 1.293 . . . . 0.0 111.405 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -59.27 -44.82 92.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.489 0.715 . . . . 0.0 112.417 170.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -61.34 -43.12 99.41 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.079 0.854 . . . . 0.0 111.037 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.04 99.57 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 120.784 -1.197 . . . . 0.0 113.082 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.82 -32.4 73.66 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 121.317 -0.864 . . . . 0.0 113.116 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 35.3 tp -71.13 -31.98 68.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.667 1.587 . . . . 0.0 111.783 172.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.3 -44.93 93.62 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.985 -1.072 . . . . 0.0 111.135 169.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -52.88 -46.13 67.79 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.097 1.359 . . . . 0.0 111.417 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.33 96.86 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.72 -45.61 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.241 1.016 . . . . 0.0 111.016 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -60.18 -34.48 73.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.76 0.824 . . . . 0.0 112.665 177.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -80.82 -36.07 32.09 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.98 -31.18 68.53 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.63 -11.25 60.36 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 74.5 mt -114.19 -31.6 6.27 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.363 1.865 . . . . 0.0 113.42 -173.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.8 p -72.88 -20.87 61.02 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.045 1.738 . . . . 0.0 115.563 -172.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.23 -20.32 30.51 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.637 1.113 . . . . 0.0 114.313 176.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -128.38 147.02 62.08 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 127.861 2.465 . . . . 0.0 106.925 169.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -42.26 154.04 0.12 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.86 3.04 . . . . 0.0 114.511 169.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.6 162.24 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 126.119 1.768 . . . . 0.0 108.657 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.49 178.37 33.86 Favored Glycine 0 N--CA 1.468 0.828 0 CA-C-N 120.752 1.615 . . . . 0.0 115.35 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.6 124.11 53.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.737 1.215 . . . . 0.0 110.178 177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -79.39 139.87 37.61 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 126.599 1.96 . . . . 0.0 109.433 169.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -138.39 134.53 34.26 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 125.406 1.482 . . . . 0.0 108.872 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.1 t -142.76 -175.67 4.58 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.946 1.298 . . . . 0.0 111.843 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -55.69 -26.96 47.64 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -169.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.84 -5.37 1.33 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.52 175.66 13.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.621 1.168 . . . . 0.0 112.317 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 32.4 p90 -151.8 157.95 42.63 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.451 1.901 . . . . 0.0 110.138 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.5 ttp180 -159.26 134.15 8.1 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.804 1.242 . . . . 0.0 112.39 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.2 mt -68.21 147.01 12.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 123.811 0.844 . . . . 0.0 110.114 176.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 84.4 mtp -135.99 154.46 51.07 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.942 1.697 . . . . 0.0 111.249 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 m -146.85 165.23 20.02 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 126.16 1.784 . . . . 0.0 111.256 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -62.93 159.14 39.53 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.168 1.912 . . . . 0.0 111.184 169.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -152.87 -62.16 0.01 OUTLIER Glycine 0 N--CA 1.475 1.235 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -65.63 -29.43 70.01 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.313 1.056 . . . . 0.0 113.625 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 t -154.1 137.64 10.54 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 125.102 1.361 . . . . 0.0 110.375 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -80.75 2.62 8.41 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.127 3.218 . . . . 0.0 113.193 170.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.0 m -122.43 -2.25 9.0 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -148.01 153.52 39.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.205 1.002 . . . . 0.0 111.914 173.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.8 t-105 -53.14 105.56 0.13 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.858 1.663 . . . . 0.0 114.331 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.515 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.8 tpm_? -156.05 159.01 38.75 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.999 1.72 . . . . 0.0 110.207 169.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.515 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 96.6 m95 -140.04 139.32 35.93 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.265 1.426 . . . . 0.0 112.093 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.51 154.87 73.79 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 126.907 2.083 . . . . 0.0 109.411 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.47 136.27 36.15 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.531 2.154 . . . . 0.0 112.616 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.72 -16.95 64.25 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.842 1.257 . . . . 0.0 112.869 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -48.36 -18.94 0.26 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.319 1.848 . . . . 0.0 113.438 168.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -50.75 -28.62 9.57 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.796 1.239 . . . . 0.0 113.883 169.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -139.71 0.26 1.8 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 117.119 2.266 . . . . 0.0 117.119 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.39 57.57 1.8 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.706 1.203 . . . . 0.0 109.515 169.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.68 -27.27 0.47 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 118.266 2.691 . . . . 0.0 118.266 -169.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -129.73 2.89 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 114.576 1.324 . . . . 0.0 114.576 -174.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -127.11 -13.06 5.73 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.533 1.133 . . . . 0.0 113.634 -178.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 52.1 p -73.66 -10.72 59.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.93 1.292 . . . . 0.0 114.411 172.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -121.18 177.25 5.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.031 1.732 . . . . 0.0 111.482 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -54.17 126.29 22.35 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.04 0.924 . . . . 0.0 112.954 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -157.49 29.94 0.28 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 128.993 2.917 . . . . 0.0 107.41 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -112.83 -9.32 13.67 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -167.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.39 170.21 16.42 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.391 1.076 . . . . 0.0 113.552 -175.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -138.92 2.46 2.15 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.71 1.204 . . . . 0.0 114.246 173.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -156.47 17.02 0.33 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.131 0.972 . . . . 0.0 113.444 -169.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.52 157.16 32.64 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.345 -1.472 . . . . 0.0 113.086 -169.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.8 t -135.82 142.85 44.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.854 2.062 . . . . 0.0 109.063 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.99 147.18 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.597 1.159 . . . . 0.0 111.14 -169.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -137.22 162.47 33.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.092 1.757 . . . . 0.0 110.264 173.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 73.6 mt -127.91 158.73 37.02 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.14 139.93 13.56 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 125.684 1.594 . . . . 0.0 109.227 169.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -76.4 -7.59 27.93 Favored 'Cis proline' 0 CA--C 1.545 1.043 0 CA-C-N 121.537 1.585 . . . . 0.0 113.399 -8.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -62.96 177.94 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.262 1.425 . . . . 0.0 112.167 169.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -135.78 146.68 58.1 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.6 1.16 . . . . 0.0 113.352 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -81.57 107.05 1.75 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.439 2.759 . . . . 0.0 110.115 169.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -157.77 160.01 37.39 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.087 0.955 . . . . 0.0 112.342 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.99 38.43 0.11 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 127.468 2.307 . . . . 0.0 114.02 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.8 m -59.4 156.62 12.56 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.008 1.723 . . . . 0.0 114.353 -175.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -69.6 -0.98 7.63 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.402 1.481 . . . . 0.0 114.629 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -143.58 165.19 26.28 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 127.448 2.299 . . . . 0.0 110.278 -176.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.72 155.82 64.95 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.172 1.915 . . . . 0.0 111.965 169.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -91.24 -14.95 30.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.663 1.185 . . . . 0.0 112.493 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.3 t -132.46 139.22 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 126.103 1.761 . . . . 0.0 109.078 177.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 83.1 t -133.09 147.53 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 119.443 1.02 . . . . 0.0 112.227 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -126.86 116.43 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 128.66 2.784 . . . . 0.0 108.942 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -70.83 160.32 32.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.209 1.804 . . . . 0.0 111.981 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.97 -7.05 10.03 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -121.67 10.67 10.38 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 0.0 112.992 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.95 7.86 63.91 Favored Glycine 0 CA--C 1.535 1.331 0 N-CA-C 115.963 1.145 . . . . 0.0 115.963 173.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -75.65 150.95 37.84 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.947 1.373 . . . . 0.0 107.801 169.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.5 mm -130.41 143.61 40.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 124.531 1.132 . . . . 0.0 108.939 -172.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 p -52.05 118.89 13.01 Favored Pre-proline 0 N--CA 1.473 0.699 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.1 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.78 115.06 2.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.016 2.477 . . . . 0.0 112.811 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.514 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.8 p90 -155.03 179.14 9.43 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.006 1.323 . . . . 0.0 112.908 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.9 p -143.24 152.91 42.25 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 125.331 1.452 . . . . 0.0 110.883 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.45 119.21 17.2 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 127.265 2.226 . . . . 0.0 108.806 -169.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.2 tt -110.94 145.86 37.62 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.349 1.46 . . . . 0.0 110.353 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 42.9 mtt -127.29 129.99 48.71 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.816 1.247 . . . . 0.0 110.355 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -129.99 141.71 50.72 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.528 1.531 . . . . 0.0 112.192 -171.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -61.05 109.92 1.22 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.321 1.849 . . . . 0.0 110.925 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -18.22 57.03 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -177.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.59 -16.47 68.38 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.314 0.959 . . . . 0.0 114.561 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.8 m -130.53 -27.53 2.15 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.706 1.253 . . . . 0.0 113.64 -169.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.83 36.86 40.77 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.1 0.857 . . . . 0.0 113.09 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -131.83 129.05 21.82 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.221 1.409 . . . . 0.0 111.071 -170.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.54 148.54 52.76 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.841 3.027 . . . . 0.0 114.914 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.12 -38.94 2.97 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.109 1.364 . . . . 0.0 110.973 169.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 39.9 tp -148.58 152.51 36.91 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 126.256 1.822 . . . . 0.0 110.151 -168.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.2 m -145.15 148.88 34.07 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 124.452 1.101 . . . . 0.0 108.931 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.6 mp -117.98 146.55 43.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 127.253 2.221 . . . . 0.0 108.405 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.23 141.67 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.122 0.969 . . . . 0.0 111.298 -174.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 21.9 t -120.38 121.25 38.15 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.94 1.696 . . . . 0.0 111.662 -176.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 61.7 p -74.94 -14.52 60.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.76 1.224 . . . . 0.0 114.004 170.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.33 2.77 4.02 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 125.786 1.66 . . . . 0.0 114.449 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.7 t -152.91 161.09 42.98 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.956 1.378 . . . . 0.0 113.136 -175.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -46.98 144.81 3.62 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 127.435 2.294 . . . . 0.0 113.774 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -107.87 17.25 6.93 Favored 'Cis proline' 0 CA--C 1.55 1.312 0 CA-C-N 120.744 1.301 . . . . 0.0 114.381 -2.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp 74.29 168.49 0.3 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 127.696 2.398 . . . . 0.0 112.405 -169.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -129.14 135.78 49.33 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.514 1.126 . . . . 0.0 111.558 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -82.68 155.77 24.18 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.725 1.21 . . . . 0.0 112.82 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 10.9 t -151.23 140.66 21.5 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.607 1.963 . . . . 0.0 109.976 169.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.61 130.63 43.63 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.389 -0.82 . . . . 0.0 109.383 169.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.07 63.2 0.27 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.376 1.871 . . . . 0.0 115.381 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 47.72 24.01 0.5 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 117.737 2.495 . . . . 0.0 117.737 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -57.67 -28.91 64.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -175.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.5 p -91.41 -8.15 48.7 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 175.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -63.95 -39.71 47.85 Favored Pre-proline 0 N--CA 1.478 0.975 0 CA-C-O 115.95 -1.976 . . . . 0.0 115.019 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo . . . . . 0 C--O 1.251 1.127 0 C-N-CA 124.09 3.194 . . . . 0.0 115.296 177.425 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.46 -14.68 5.26 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.734 2.413 . . . . 0.0 114.761 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.2 t -118.13 -41.61 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.334 1.454 . . . . 0.0 110.514 170.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.39 79.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.301 0.955 . . . . 0.0 113.531 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.618 ' HA ' HD11 ' A' ' 121' ' ' LEU . 11.1 m120 -57.06 -34.93 68.75 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.188 0.904 . . . . 0.0 113.284 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.8 m -81.84 -49.85 9.89 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.183 0.993 . . . . 0.0 111.053 174.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -67.28 -26.67 66.66 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' HD12 ' A' ' 121' ' ' LEU . . . -63.9 -43.94 94.46 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.719 1.145 . . . . 0.0 111.812 169.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -67.19 -37.88 84.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.887 0.875 . . . . 0.0 110.922 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -63.06 -46.15 88.82 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.6 m -58.74 -40.91 85.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.934 0.893 . . . . 0.0 111.242 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.34 92.98 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.573 1.149 . . . . 0.0 113.297 174.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.53 96.86 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.801 . . . . 0.0 112.056 173.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.7 mtt85 -62.75 -45.65 91.7 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.561 1.144 . . . . 0.0 111.553 175.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -57.95 -45.33 86.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.727 0.811 . . . . 0.0 112.559 170.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.6 m -62.01 -43.29 99.14 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.886 0.766 . . . . 0.0 111.02 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.16 96.65 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.869 -1.144 . . . . 0.0 112.968 172.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.56 -32.14 73.57 Favored 'General case' 0 CA--C 1.547 0.842 0 O-C-N 121.346 -0.846 . . . . 0.0 113.269 175.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 tp -72.51 -34.68 67.78 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.879 1.272 . . . . 0.0 111.74 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.42 -45.09 94.68 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.969 -1.082 . . . . 0.0 110.778 169.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.89 -46.54 64.57 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.325 1.45 . . . . 0.0 110.921 169.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.16 -39.54 94.97 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.62 -46.33 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.833 0.853 . . . . 0.0 110.784 174.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.08 -38.17 87.8 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.137 0.575 . . . . 0.0 112.525 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -68.18 -34.15 75.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.402 1.081 . . . . 0.0 112.281 175.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -24.67 64.15 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.9 t -83.46 -12.32 56.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.262 0.937 . . . . 0.0 112.884 173.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.88 -27.57 9.64 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.367 1.067 . . . . 0.0 113.559 -174.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.0 m -85.12 -20.74 29.84 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.59 0.59 89.28 Favored Glycine 0 CA--C 1.542 1.724 0 N-CA-C 115.233 0.853 . . . . 0.0 115.233 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -142.35 151.11 57.22 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 127.611 2.364 . . . . 0.0 107.168 169.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -47.05 157.46 0.58 Allowed 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.912 2.408 . . . . 0.0 113.0 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 78.2 t -120.02 158.99 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.173 1.389 . . . . 0.0 108.904 -173.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.39 174.51 30.55 Favored Glycine 0 CA--C 1.519 0.327 0 O-C-N 121.316 -0.865 . . . . 0.0 115.102 -177.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.5 122.2 47.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 C-N-CA 124.774 1.23 . . . . 0.0 107.817 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -90.55 146.12 24.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.345 1.458 . . . . 0.0 110.579 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -140.88 131.71 25.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.977 1.711 . . . . 0.0 110.572 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 82.5 p -148.82 169.56 20.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.792 1.237 . . . . 0.0 112.495 175.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.14 -29.53 68.71 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 171.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 51.8 m -76.46 -49.88 15.48 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.262 1.025 . . . . 0.0 112.626 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.19 173.22 9.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.903 1.681 . . . . 0.0 112.1 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 38.5 p90 -127.62 147.43 50.36 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.328 1.451 . . . . 0.0 109.101 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.8 ptt-85 -155.62 147.54 23.32 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.31 1.044 . . . . 0.0 113.088 -169.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.5 mm -78.71 140.56 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.055 0.942 . . . . 0.0 109.209 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.7 mtp -136.17 148.53 48.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.164 0.986 . . . . 0.0 112.932 -177.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.6 m -143.79 169.67 9.92 Favored Pre-proline 0 N--CA 1.477 0.91 0 C-N-CA 127.709 2.404 . . . . 0.0 111.158 -169.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -54.81 -41.84 74.36 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.99 2.46 . . . . 0.0 114.312 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.87 -65.47 0.02 OUTLIER Glycine 0 CA--C 1.537 1.454 0 C-N-CA 127.624 2.535 . . . . 0.0 115.767 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -68.48 -54.63 15.66 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.28 1.432 . . . . 0.0 112.31 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.4 t -161.23 143.32 9.04 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 124.459 1.104 . . . . 0.0 112.296 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -79.93 -16.78 11.16 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 123.458 2.772 . . . . 0.0 112.789 169.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.8 m -73.92 -13.0 60.83 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -169.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -150.27 153.07 35.53 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.281 1.433 . . . . 0.0 111.031 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -58.24 113.18 1.82 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.859 1.264 . . . . 0.0 111.798 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.504 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.5 tpm_? -154.07 161.36 41.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.346 1.458 . . . . 0.0 110.174 174.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.504 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 92.7 m95 -139.8 139.64 36.45 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.991 1.316 . . . . 0.0 112.199 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.9 t -143.84 141.9 19.49 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 107.149 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -61.84 146.97 96.19 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 121.679 1.586 . . . . 0.0 111.065 170.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.4 tp -66.98 10.91 0.12 Allowed 'General case' 0 CA--C 1.555 1.155 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -61.85 -18.94 61.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.408 1.483 . . . . 0.0 112.729 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -62.05 -20.93 64.48 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.131 1.372 . . . . 0.0 113.987 171.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -146.27 -20.88 0.44 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 -175.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -111.41 11.86 21.5 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.493 1.117 . . . . 0.0 112.724 172.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.29 -169.25 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.181 2.192 . . . . 0.0 114.467 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -59.8 -11.11 4.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -68.37 -8.97 44.84 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.52 1.528 . . . . 0.0 113.763 170.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.0 m -63.64 8.87 0.07 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.609 1.964 . . . . 0.0 115.938 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -156.05 162.24 40.32 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.953 1.301 . . . . 0.0 114.113 -169.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.439 ' ND2' ' H ' ' A' ' 75' ' ' ASP . 7.2 t30 48.48 -158.36 0.06 Allowed 'General case' 0 CA--C 1.561 1.392 0 C-N-CA 126.902 2.081 . . . . 0.0 115.689 169.2 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.439 ' H ' ' ND2' ' A' ' 74' ' ' ASN . 1.0 OUTLIER 56.75 -6.76 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 120.669 3.581 . . . . 0.0 120.669 168.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -60.39 -21.13 61.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.853 1.661 . . . . 0.0 114.21 173.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -129.32 159.33 36.49 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.336 1.855 . . . . 0.0 112.244 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -141.88 18.53 2.14 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.37 1.068 . . . . 0.0 113.545 169.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.05 4.49 0.47 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.783 1.233 . . . . 0.0 113.993 -172.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -125.71 170.83 11.15 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.279 1.832 . . . . 0.0 111.5 -171.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 21.4 t -136.82 141.52 42.88 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.432 1.893 . . . . 0.0 109.123 169.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.64 145.6 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.348 1.459 . . . . 0.0 111.198 -169.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -141.05 152.31 44.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.197 1.799 . . . . 0.0 110.567 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.6 mt -118.96 144.8 46.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.211 1.004 . . . . 0.0 111.439 171.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -172.81 114.44 0.37 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 127.217 2.207 . . . . 0.0 110.585 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.74 156.4 4.28 Favored 'Cis proline' 0 N--CA 1.452 -0.922 0 CA-C-N 121.363 1.523 . . . . 0.0 115.586 -10.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 79.31 -171.8 0.05 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 130.299 3.44 . . . . 0.0 110.947 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.65 148.41 43.03 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 124.183 0.993 . . . . 0.0 113.078 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.06 84.86 1.91 Allowed 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.787 2.991 . . . . 0.0 111.39 175.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -142.71 142.83 32.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.93 1.292 . . . . 0.0 111.148 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -71.74 66.06 0.52 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.537 1.535 . . . . 0.0 114.155 -173.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.5 t -67.15 156.64 35.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.603 1.961 . . . . 0.0 113.661 -178.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -69.25 -8.4 45.58 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.32 1.448 . . . . 0.0 113.451 171.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -136.49 163.61 48.61 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 126.204 1.801 . . . . 0.0 111.368 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -69.88 145.47 56.52 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 121.814 1.676 . . . . 0.0 110.477 168.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.01 -49.4 24.49 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.043 0.537 . . . . 0.0 110.957 171.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.4 t -89.8 135.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.962 1.305 . . . . 0.0 109.663 -177.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.2 t -132.89 145.6 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.906 0.882 . . . . 0.0 111.644 -176.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -127.81 136.33 60.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 128.445 2.698 . . . . 0.0 109.279 -169.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.6 mt -104.97 161.37 14.26 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.772 0.796 . . . . 0.0 112.074 170.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.44 -22.17 41.7 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -170.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -103.59 5.13 36.38 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.952 1.301 . . . . 0.0 113.781 -177.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.51 8.74 57.19 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 115.552 0.981 . . . . 0.0 115.552 172.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -84.45 139.43 32.2 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.211 1.505 . . . . 0.0 108.161 169.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.9 mm -130.9 154.65 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 125.461 1.504 . . . . 0.0 109.858 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.1 p -55.73 127.93 68.46 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.857 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.74 126.85 11.08 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 122.203 1.935 . . . . 0.0 111.047 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.531 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.5 p90 -160.38 -177.41 6.21 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.905 1.682 . . . . 0.0 112.069 -177.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.58 148.68 39.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.698 0.799 . . . . 0.0 111.165 170.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.0 tp -133.17 120.35 21.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 127.929 2.492 . . . . 0.0 108.257 -170.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.5 tt -115.32 146.14 41.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.525 1.13 . . . . 0.0 110.413 -174.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 48.4 mtt -128.3 140.43 51.88 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 125.404 1.481 . . . . 0.0 109.561 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.09 147.59 49.58 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.742 1.217 . . . . 0.0 111.481 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -61.41 122.39 15.06 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.312 1.045 . . . . 0.0 109.838 173.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.18 -21.31 64.99 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -171.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -96.64 -28.57 8.83 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-N 119.119 0.872 . . . . 0.0 114.219 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 79.6 p -93.01 -27.94 16.7 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.682 1.241 . . . . 0.0 112.969 176.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.96 7.93 72.01 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.695 1.14 . . . . 0.0 113.354 -169.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -89.36 135.23 31.42 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.972 1.309 . . . . 0.0 111.401 -174.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.55 142.43 17.98 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 123.78 2.987 . . . . 0.0 113.517 172.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.618 HD11 ' HA ' ' A' ' 10' ' ' ASN . 1.4 tm? -131.86 -47.12 0.94 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 110.993 -169.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -144.64 156.61 44.19 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.069 1.748 . . . . 0.0 108.79 177.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 91.4 m -146.55 146.93 30.66 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 110.031 173.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.7 mp -123.49 146.99 47.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 127.431 2.293 . . . . 0.0 109.08 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 11.7 t -141.01 136.33 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.255 0.622 . . . . 0.0 111.912 -171.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.531 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.2 t -116.74 116.74 28.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.636 1.574 . . . . 0.0 110.594 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.8 p -78.19 -12.67 60.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.929 1.292 . . . . 0.0 114.295 173.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 131.7 -0.05 4.94 Favored Glycine 0 CA--C 1.538 1.494 0 C-N-CA 125.312 1.434 . . . . 0.0 114.701 -177.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.3 p -153.81 157.66 39.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.794 1.297 . . . . 0.0 113.648 -176.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -58.81 136.61 87.02 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 126.332 1.853 . . . . 0.0 115.135 177.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -96.14 176.27 10.26 Favored 'Cis proline' 0 CA--C 1.548 1.212 0 CA-C-N 120.193 1.105 . . . . 0.0 110.584 -11.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.21 153.18 44.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.93 -1.107 . . . . 0.0 111.73 169.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -81.14 170.47 16.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.118 1.367 . . . . 0.0 110.474 169.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -138.22 147.28 43.59 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.05 1.74 . . . . 0.0 111.391 176.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.5 t -150.41 150.12 30.96 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.552 1.541 . . . . 0.0 110.946 173.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.37 137.2 44.56 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 30.05 59.28 0.19 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.203 2.201 . . . . 0.0 115.565 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.255 23.4 ptt85 47.1 28.26 0.91 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 127.594 2.358 . . . . 0.0 117.215 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.41 -31.94 68.18 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.8 p -89.6 -2.12 58.22 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 173.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.3 86.33 19.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 125.436 1.494 . . . . 0.0 111.245 -169.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo . . . . . 0 C--O 1.25 1.09 0 C-N-CA 123.602 2.868 . . . . 0.0 113.102 169.872 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -65.4 -32.48 74.13 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.235 1.38 . . . . 0.0 112.613 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.11 -46.8 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.147 169.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.95 -41.98 99.67 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.024 0.829 . . . . 0.0 112.387 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -62.08 -47.52 84.28 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.763 0.825 . . . . 0.0 112.589 173.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.6 m -61.28 -52.01 66.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 122.868 0.467 . . . . 0.0 110.833 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -63.05 -34.69 78.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.404 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.62 67.84 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.657 1.571 . . . . 0.0 111.389 174.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -66.29 -42.62 88.11 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -60.52 -44.5 95.99 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.401 0.68 . . . . 0.0 112.15 171.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.9 m -57.64 -44.19 85.44 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.285 0.948 . . . . 0.0 111.424 174.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.4 -43.65 98.31 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.86 -44.05 94.29 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.645 -0.659 . . . . 0.0 112.246 175.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -65.43 -44.19 88.13 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.71 -0.619 . . . . 0.0 111.495 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.0 -41.73 92.73 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.529 0.732 . . . . 0.0 111.984 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.5 m -60.49 -42.97 97.4 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.069 0.85 . . . . 0.0 111.473 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.72 -40.71 92.47 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.833 -1.167 . . . . 0.0 113.225 173.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.97 -31.59 72.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.039 0.936 . . . . 0.0 113.005 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.0 tp -70.44 -36.85 74.19 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.789 1.236 . . . . 0.0 111.399 172.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -62.8 -44.88 94.99 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 121.056 -1.027 . . . . 0.0 111.8 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -54.07 -46.18 71.93 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.722 1.209 . . . . 0.0 111.796 170.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.49 -41.77 86.08 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 174.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.4 mt -62.41 -47.12 94.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 119.274 0.943 . . . . 0.0 110.512 173.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.05 -24.54 67.15 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.363 1.065 . . . . 0.0 113.775 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.06 -30.71 12.89 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -27.58 66.85 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 120.218 1.372 . . . . 0.0 113.691 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -74.13 -25.43 59.76 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.25 -27.45 13.19 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.38 1.072 . . . . 0.0 113.63 -173.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.7 m -86.84 -7.67 58.01 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.58 -3.06 80.5 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 124.592 1.091 . . . . 0.0 115.522 172.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -146.37 151.96 45.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 127.83 2.452 . . . . 0.0 107.294 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -42.12 153.01 0.14 Allowed 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 124.375 3.383 . . . . 0.0 115.303 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 74.3 t -110.78 162.51 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 126.331 1.852 . . . . 0.0 108.822 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.28 176.24 35.29 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 116.611 1.404 . . . . 0.0 116.611 -175.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 4.4 mp -135.24 131.01 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 125.378 1.471 . . . . 0.0 109.331 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -95.32 148.47 22.39 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.123 1.369 . . . . 0.0 110.928 173.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -138.79 143.36 38.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.079 1.752 . . . . 0.0 111.022 -173.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 77.8 p -142.05 176.37 9.01 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.734 1.614 . . . . 0.0 111.569 -173.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.94 -32.15 52.77 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.09 1.57 2.04 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -171.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.68 174.8 14.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.935 1.294 . . . . 0.0 112.598 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -143.02 159.99 41.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 127.044 2.138 . . . . 0.0 108.569 173.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -152.49 150.72 29.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.88 144.04 12.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.772 0.829 . . . . 0.0 110.431 176.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -135.39 147.89 49.19 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.754 1.622 . . . . 0.0 110.958 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.6 m -140.75 161.91 51.68 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 125.063 1.345 . . . . 0.0 110.875 -170.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -49.76 144.74 19.56 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.238 2.625 . . . . 0.0 114.751 177.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.39 -156.42 7.87 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.017 1.294 . . . . 0.0 114.145 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -53.46 -22.1 7.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -173.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.8 t -146.96 143.61 18.64 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.922 1.289 . . . . 0.0 112.158 -177.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.68 -10.98 12.94 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 123.66 2.907 . . . . 0.0 112.372 169.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.1 t -65.03 -25.31 67.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.948 1.299 . . . . 0.0 113.907 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.52 157.92 43.77 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.45 1.5 . . . . 0.0 111.209 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 44.3 t-105 -53.23 115.44 1.9 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.646 1.578 . . . . 0.0 112.079 177.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.4 tpp85 -155.89 152.22 28.03 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.241 1.416 . . . . 0.0 110.885 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -144.1 150.82 38.73 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 26.8 m -144.17 153.89 56.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 126.237 1.815 . . . . 0.0 110.191 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.31 147.84 72.85 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.137 1.891 . . . . 0.0 110.261 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.8 tp -78.16 52.98 1.15 Allowed 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.849 0.833 . . . . 0.0 111.037 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -128.83 18.71 6.15 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.442 1.497 . . . . 0.0 113.359 -169.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -63.14 -25.07 68.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.86 0.864 . . . . 0.0 113.052 172.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -149.46 -36.71 0.16 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.711 1.204 . . . . 0.0 113.406 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.74 29.46 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.645 1.578 . . . . 0.0 113.65 171.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.4 -37.63 49.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.177 1.791 . . . . 0.0 115.018 -169.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -103.59 12.09 35.37 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.466 1.507 . . . . 0.0 112.89 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -130.27 -33.74 1.68 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.752 1.221 . . . . 0.0 113.076 -172.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 75.2 m -75.63 9.15 2.41 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.186 1.394 . . . . 0.0 114.35 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -143.61 157.08 44.69 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.699 1.2 . . . . 0.0 112.67 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 40.64 -1.32 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 170.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.12 -27.83 69.35 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 121.652 2.024 . . . . 0.0 114.588 -173.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -70.06 -17.07 63.23 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.141 1.376 . . . . 0.0 113.91 -174.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -136.68 152.39 50.34 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.607 1.563 . . . . 0.0 114.161 -169.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -141.97 -6.77 0.96 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -141.98 18.34 2.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.06 1.344 . . . . 0.0 111.972 -169.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -125.9 154.88 42.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.57 1.148 . . . . 0.0 112.824 -169.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.1 m -127.47 145.37 50.86 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 127.52 2.328 . . . . 0.0 108.518 169.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -118.04 148.67 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.592 1.157 . . . . 0.0 111.108 -169.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -138.06 151.28 47.69 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.27 1.828 . . . . 0.0 109.664 172.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.2 tt -148.02 146.03 28.74 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.893 0.877 . . . . 0.0 111.439 -174.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.69 153.63 43.28 Favored Pre-proline 0 N--CA 1.472 0.646 0 C-N-CA 125.775 1.63 . . . . 0.0 111.227 176.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -81.48 -13.31 37.45 Favored 'Cis proline' 0 CA--C 1.543 0.926 0 CA-C-N 120.542 1.229 . . . . 0.0 114.426 0.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -63.46 142.75 58.28 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.78 1.232 . . . . 0.0 112.945 -176.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -59.56 112.99 6.03 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.024 1.73 . . . . 0.0 111.67 172.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -86.03 -178.78 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.228 2.618 . . . . 0.0 112.407 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.1 t70 70.96 -44.95 0.6 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 119.104 3.001 . . . . 0.0 119.104 168.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -138.77 12.7 2.7 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -170.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.6 t -56.93 150.54 16.45 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -74.08 -11.52 60.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.898 1.279 . . . . 0.0 113.252 171.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.13 162.37 58.04 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 125.354 1.462 . . . . 0.0 111.507 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -65.14 140.28 64.45 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.503 1.468 . . . . 0.0 110.306 169.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -71.01 -22.0 62.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.668 0.787 . . . . 0.0 112.509 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 62.1 t -116.33 128.19 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.883 0.873 . . . . 0.0 109.753 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.3 t -131.18 140.84 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.478 1.111 . . . . 0.0 110.554 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -126.53 124.24 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 126.575 1.95 . . . . 0.0 110.983 -169.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.7 mt -82.69 159.59 22.58 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.172 0.987 . . . . 0.0 112.041 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.35 -25.81 62.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.966 1.306 . . . . 0.0 114.345 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -87.64 -0.37 56.78 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 113.513 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.94 10.92 80.08 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.344 -0.847 . . . . 0.0 114.323 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -79.38 142.25 36.16 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.574 -0.957 . . . . 0.0 109.232 169.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -132.65 145.85 33.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 125.239 1.416 . . . . 0.0 109.094 -169.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.5 p -52.16 135.08 40.29 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 123.842 0.857 . . . . 0.0 112.286 169.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -70.78 123.48 9.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.763 2.309 . . . . 0.0 110.658 169.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.482 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 29.0 p90 -158.6 175.61 13.43 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.094 1.358 . . . . 0.0 112.14 175.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -137.68 144.72 41.94 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.227 1.411 . . . . 0.0 108.502 169.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.8 tp -136.85 116.15 12.63 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.658 1.983 . . . . 0.0 109.215 -169.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -110.42 146.35 36.02 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.953 1.301 . . . . 0.0 110.607 -175.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.4 mtt -126.11 138.24 53.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.773 1.629 . . . . 0.0 109.293 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -139.42 149.5 44.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.126 1.37 . . . . 0.0 111.69 -174.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -63.92 118.69 8.77 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.572 0.749 . . . . 0.0 110.699 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.29 -23.45 62.43 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -85.57 -17.69 61.6 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 123.873 0.749 . . . . 0.0 114.241 175.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.1 m -118.81 -24.55 6.6 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 118.21 1.005 . . . . 0.0 113.266 -169.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 64.29 33.82 88.27 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 123.604 0.621 . . . . 0.0 112.789 -171.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -125.93 127.04 24.84 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.59 1.556 . . . . 0.0 110.379 -170.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -51.74 148.01 23.02 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.204 3.269 . . . . 0.0 115.553 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.64 -51.76 1.93 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 127.101 2.16 . . . . 0.0 111.51 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -150.64 155.37 39.23 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.776 1.631 . . . . 0.0 108.637 -169.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.0 m -145.66 138.39 25.87 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 110.052 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.1 mp -111.2 149.22 31.27 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.363 2.265 . . . . 0.0 109.795 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 28.3 t -144.42 138.25 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.696 1.198 . . . . 0.0 111.871 -169.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.482 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 14.1 t -117.28 158.18 24.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.433 1.493 . . . . 0.0 112.125 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 83.0 p -133.06 -2.02 3.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.727 1.611 . . . . 0.0 114.311 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 125.3 -14.33 7.36 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.912 1.244 . . . . 0.0 115.101 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 55.7 m -142.35 152.55 43.01 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.826 1.251 . . . . 0.0 112.436 -172.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 47.5 t-105 -53.7 134.68 55.32 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.471 1.509 . . . . 0.0 114.678 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -99.9 178.2 6.05 Favored 'Cis proline' 0 CA--C 1.55 1.276 0 CA-C-N 120.53 1.225 . . . . 0.0 111.272 -11.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.461 HD21 ' CZ ' ' A' ' 108' ' ' PHE . 3.7 mp -67.76 168.6 11.11 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.191 -0.943 . . . . 0.0 112.079 169.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -114.08 164.6 13.61 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.389 1.475 . . . . 0.0 109.654 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -142.88 156.33 44.9 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.2 t -151.5 154.64 36.94 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.37 1.868 . . . . 0.0 111.084 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.01 133.82 47.64 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.494 -0.754 . . . . 0.0 109.047 169.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.82 63.1 0.13 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.646 1.978 . . . . 0.0 115.637 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 55.7 ptt85 46.46 25.77 0.43 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 127.83 2.452 . . . . 0.0 117.252 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.63 -33.62 71.74 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 -174.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.9 p -77.48 -20.95 53.59 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 20.1 mtp-105 -74.07 152.51 88.52 Favored Pre-proline 0 N--CA 1.475 0.795 0 C-N-CA 124.073 0.949 . . . . 0.0 112.768 -170.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 C--O 1.249 1.048 0 C-N-CA 123.788 2.992 . . . . 0.0 113.172 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.16 -36.43 79.79 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.126 1.33 . . . . 0.0 112.782 170.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.8 t -70.16 -41.84 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.62 0.768 . . . . 0.0 110.127 173.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.8 -39.88 95.65 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.666 -0.646 . . . . 0.0 112.586 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -62.01 -46.34 89.62 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.682 0.793 . . . . 0.0 111.804 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.0 m -55.75 -53.81 52.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.143 0.577 . . . . 0.0 110.73 174.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.1 mmt-85 -62.12 -36.11 80.77 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 117.488 -1.244 . . . . 0.0 112.661 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.1 66.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 121.103 1.774 . . . . 0.0 111.722 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -63.87 -42.39 97.54 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.063 1.345 . . . . 0.0 111.666 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -64.79 -44.72 89.02 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.775 1.63 . . . . 0.0 112.99 174.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -62.92 -38.68 91.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.388 1.075 . . . . 0.0 111.273 175.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.09 84.24 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.57 -43.75 98.28 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.705 -0.622 . . . . 0.0 111.954 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -61.05 -48.95 79.38 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.787 1.235 . . . . 0.0 111.446 177.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -61.02 -42.29 98.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.779 -0.629 . . . . 0.0 112.399 174.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.9 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.439 1.018 . . . . 0.0 111.013 176.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.31 -42.22 99.0 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.973 -1.079 . . . . 0.0 113.396 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.1 -33.78 76.55 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.228 -0.92 . . . . 0.0 112.882 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.7 tp -71.3 -31.89 67.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.875 1.27 . . . . 0.0 111.797 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -62.97 -44.57 95.68 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.07 -1.019 . . . . 0.0 110.69 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 tp -54.02 -46.57 71.85 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.805 1.242 . . . . 0.0 111.468 169.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.0 -45.31 90.96 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.1 mt -61.98 -46.22 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 110.863 175.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -62.74 -33.37 75.0 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.933 0.893 . . . . 0.0 113.025 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -82.06 -27.03 33.18 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.247 1.019 . . . . 0.0 113.562 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.08 -38.32 85.83 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.927 1.24 . . . . 0.0 114.26 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.6 t -68.82 -32.5 72.25 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.407 -0.808 . . . . 0.0 112.144 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.86 -32.96 59.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.383 1.473 . . . . 0.0 112.804 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 75.0 m -72.23 -24.58 61.4 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.516 1.526 . . . . 0.0 114.446 -174.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.27 13.2 64.54 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 123.749 0.69 . . . . 0.0 114.153 -174.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -152.96 150.61 24.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.893 2.877 . . . . 0.0 107.178 -178.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -50.24 161.36 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.616 2.211 . . . . 0.0 112.824 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.0 t -122.55 159.65 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 125.15 1.38 . . . . 0.0 108.214 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.86 -174.8 28.02 Favored Glycine 0 N--CA 1.464 0.563 0 O-C-N 120.603 -1.31 . . . . 0.0 115.155 -176.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -125.64 127.96 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.491 1.116 . . . . 0.0 108.963 174.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -97.71 98.12 9.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.575 1.55 . . . . 0.0 108.275 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -84.85 126.55 33.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.54 1.136 . . . . 0.0 109.162 171.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 87.9 p -126.34 9.17 7.23 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -175.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 64.66 -37.46 0.21 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 128.338 2.655 . . . . 0.0 114.84 -172.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -62.66 -40.89 98.48 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.197 1.399 . . . . 0.0 111.516 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.8 -174.66 4.03 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 128.061 2.545 . . . . 0.0 109.29 169.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -147.63 135.1 20.78 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.108 -0.995 . . . . 0.0 110.492 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.37 151.28 39.07 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.769 1.228 . . . . 0.0 112.383 -173.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.1 mt -71.54 149.19 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.546 0.738 . . . . 0.0 109.142 171.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 6.0 ttt -138.55 139.53 38.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.228 1.411 . . . . 0.0 110.3 -172.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.54 164.55 30.0 Favored Pre-proline 0 N--CA 1.479 1.023 0 C-N-CA 126.492 1.917 . . . . 0.0 111.286 -169.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -68.01 164.46 31.82 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 121.787 1.658 . . . . 0.0 111.791 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.63 -59.69 0.01 OUTLIER Glycine 0 N--CA 1.472 1.066 0 CA-C-O 119.568 -0.573 . . . . 0.0 114.183 177.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -65.81 -30.78 71.46 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.272 1.036 . . . . 0.0 113.763 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.5 t -157.11 138.71 9.89 Favored Pre-proline 0 N--CA 1.471 0.616 0 C-N-CA 124.608 1.163 . . . . 0.0 110.95 169.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -87.05 4.69 6.08 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.266 3.311 . . . . 0.0 113.399 171.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.2 p -45.72 -58.54 3.38 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -162.95 -36.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.126 1.371 . . . . 0.0 113.462 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -152.84 106.22 3.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.818 0.847 . . . . 0.0 112.118 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.1 tpp85 -155.9 151.58 27.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.338 1.855 . . . . 0.0 109.607 169.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -144.54 135.83 25.36 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.7 m -143.01 151.64 56.5 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 128.255 2.622 . . . . 0.0 108.953 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.06 135.28 40.02 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 122.222 1.948 . . . . 0.0 111.095 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 tt -71.63 88.55 0.96 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.539 1.136 . . . . 0.0 109.317 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -135.74 -10.51 2.09 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -58.54 -27.68 64.76 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.651 1.114 . . . . 0.0 113.845 -177.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -135.94 24.56 3.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.454 1.902 . . . . 0.0 112.776 174.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.56 35.37 2.46 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.856 2.062 . . . . 0.0 109.718 172.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.72 118.58 4.34 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.049 1.74 . . . . 0.0 112.648 -169.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.1 t70 54.32 21.77 3.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.886 1.674 . . . . 0.0 115.101 -177.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -133.69 -12.18 2.66 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.9 t -63.87 -24.46 67.75 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.242 1.017 . . . . 0.0 113.551 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -151.6 165.61 33.77 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.762 1.225 . . . . 0.0 113.269 -177.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.74 -37.13 0.06 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 129.398 3.079 . . . . 0.0 116.66 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.91 -6.58 22.61 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.016 2.126 . . . . 0.0 113.935 173.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -42.97 -48.45 5.93 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.395 1.878 . . . . 0.0 114.574 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -158.16 -178.41 7.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.142 1.377 . . . . 0.0 112.549 -169.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -139.12 18.17 2.61 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.116 1.366 . . . . 0.0 112.922 171.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -146.93 -2.99 0.6 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.0 mt -118.08 160.08 22.12 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 -169.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.5 t -132.74 133.72 43.84 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.93 2.492 . . . . 0.0 107.802 169.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -109.66 145.62 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.542 1.137 . . . . 0.0 111.038 -169.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -136.99 155.2 50.01 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.965 1.706 . . . . 0.0 110.713 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.2 tt -145.62 147.36 31.95 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.604 1.161 . . . . 0.0 112.523 -169.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' N ' HD23 ' A' ' 84' ' ' LEU . 5.0 pp0? -154.03 153.44 28.49 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.282 1.833 . . . . 0.0 109.607 168.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -76.5 -13.62 27.25 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 120.84 1.336 . . . . 0.0 113.938 -2.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -67.85 173.15 4.64 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.339 1.056 . . . . 0.0 111.953 171.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.13 135.06 26.84 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.725 1.21 . . . . 0.0 112.449 -173.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.89 100.05 1.34 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.474 2.783 . . . . 0.0 109.87 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -159.93 141.85 13.02 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.321 1.449 . . . . 0.0 110.571 -171.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -59.83 87.05 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.736 1.214 . . . . 0.0 112.131 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.4 m -101.93 -6.57 23.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.361 1.864 . . . . 0.0 113.085 -169.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.0 20.97 4.63 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.729 2.011 . . . . 0.0 114.277 -177.05 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -157.29 163.47 24.83 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 127.244 2.218 . . . . 0.0 108.624 175.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.58 155.63 66.01 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 CA-C-N 120.26 1.129 . . . . 0.0 110.883 169.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -107.2 -44.88 4.25 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.088 0.555 . . . . 0.0 110.826 170.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.0 t -79.47 132.47 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.8 t -134.08 145.29 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.997 0.919 . . . . 0.0 111.865 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.72 131.53 72.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 C-N-CA 129.644 3.178 . . . . 0.0 107.984 -172.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.8 mt -96.43 157.72 15.77 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.279 0.562 . . . . 0.0 111.151 169.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.64 -22.73 47.29 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.28 -18.62 61.78 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.802 1.641 . . . . 0.0 113.507 174.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.36 5.18 63.75 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 124.933 1.254 . . . . 0.0 114.611 -176.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.29 144.25 29.84 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 118.323 1.062 . . . . 0.0 108.99 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 3.8 mm -131.47 150.27 34.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 125.334 1.454 . . . . 0.0 110.088 -168.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.6 p -57.59 121.91 52.13 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.685 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.36 127.98 28.22 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 122.736 2.29 . . . . 0.0 113.373 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -161.48 175.17 12.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.069 1.348 . . . . 0.0 112.558 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 79.1 p -136.42 150.02 48.56 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 123.749 0.82 . . . . 0.0 111.044 168.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.0 tp -130.38 106.35 8.49 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.795 2.038 . . . . 0.0 108.041 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -98.48 145.46 26.75 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.924 1.29 . . . . 0.0 110.022 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.2 mtt -128.67 128.96 45.13 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.905 1.682 . . . . 0.0 108.895 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.7 144.28 50.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 124.99 1.316 . . . . 0.0 110.764 -178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -69.61 104.54 2.4 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.089 1.356 . . . . 0.0 110.004 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.62 -20.98 66.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.625 1.17 . . . . 0.0 114.132 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -99.14 -7.19 55.2 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.775 1.179 . . . . 0.0 114.818 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.2 m -124.17 -29.11 3.62 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.579 1.152 . . . . 0.0 112.327 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 103.24 22.66 9.01 Favored Glycine 0 CA--C 1.534 1.275 0 N-CA-C 116.659 1.424 . . . . 0.0 116.659 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -140.18 143.46 33.8 Favored Pre-proline 0 N--CA 1.477 0.887 0 CA-C-N 119.491 1.645 . . . . 0.0 112.972 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.67 147.86 29.74 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.784 2.989 . . . . 0.0 113.503 169.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.87 -47.49 1.14 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.156 1.382 . . . . 0.0 112.513 -169.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -151.65 154.21 35.94 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.973 1.309 . . . . 0.0 108.954 -174.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 57.9 m -146.07 141.39 27.55 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 120.896 -1.127 . . . . 0.0 110.26 176.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.9 mp -113.35 148.95 34.73 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 126.589 1.955 . . . . 0.0 108.911 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.2 t -141.57 137.2 32.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.444 0.698 . . . . 0.0 111.875 -173.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.76 113.98 21.45 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.152 1.381 . . . . 0.0 110.94 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.7 m -75.52 -12.85 60.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 139.91 -3.09 2.5 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.851 1.215 . . . . 0.0 115.547 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 9.5 t -151.81 153.43 34.23 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.306 1.553 . . . . 0.0 112.87 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.5 t-105 -59.97 141.48 89.78 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 126.145 1.778 . . . . 0.0 115.244 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -91.44 176.05 17.44 Favored 'Cis proline' 0 CA--C 1.544 0.992 0 CA-C-N 119.793 0.962 . . . . 0.0 110.88 -11.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -67.96 152.69 45.14 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 122.226 1.012 . . . . 0.0 111.906 170.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.96 169.38 16.85 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.169 1.387 . . . . 0.0 109.523 169.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -137.51 147.21 45.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.339 1.456 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.2 t -152.13 154.57 36.14 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.247 1.419 . . . . 0.0 110.992 174.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.97 133.84 41.62 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 31.77 61.37 0.29 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.752 2.021 . . . . 0.0 115.551 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.305 0.0 OUTLIER 49.64 11.3 0.05 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 128.528 2.731 . . . . 0.0 118.209 -176.86 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.18 -34.07 63.54 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 3.2 m -91.68 -10.15 41.26 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.484 1.113 . . . . 0.0 113.288 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -64.97 -41.54 55.5 Favored Pre-proline 0 N--CA 1.478 0.961 0 CA-C-O 116.508 -1.711 . . . . 0.0 115.029 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo . . . . . 0 C--O 1.25 1.114 0 C-N-CA 124.317 3.345 . . . . 0.0 115.349 176.558 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -153.74 -30.69 0.12 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.54 1.536 . . . . 0.0 112.594 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.75 -29.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -43.09 -53.24 5.02 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 117.299 2.333 . . . . 0.0 117.299 -167.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 121' ' ' LEU . 18.6 t-20 -65.51 -21.11 66.59 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.7 m -93.43 -51.95 4.74 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.221 1.409 . . . . 0.0 110.487 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 tpt85 -59.23 -33.81 71.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.012 2.125 . . . . 0.0 113.091 -177.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.05 95.11 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.434 1.47 . . . . 0.0 112.597 173.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -67.04 -41.67 86.15 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.464 1.106 . . . . 0.0 110.871 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.07 -41.46 99.44 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.635 0.774 . . . . 0.0 112.168 172.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.6 m -61.13 -41.6 97.02 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.406 1.082 . . . . 0.0 111.184 175.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.09 -41.14 91.07 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.54 91.52 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.517 -0.739 . . . . 0.0 111.884 173.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -58.47 -46.99 85.5 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.299 1.439 . . . . 0.0 111.038 174.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -63.58 -42.88 98.26 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.44 1.096 . . . . 0.0 112.688 177.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.7 m -61.7 -44.73 96.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 118.727 0.694 . . . . 0.0 110.864 176.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.25 -41.79 98.76 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.144 -0.972 . . . . 0.0 113.082 173.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.09 -31.33 70.87 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.263 -0.898 . . . . 0.0 113.374 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.6 tp -71.15 -32.79 69.37 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.482 1.113 . . . . 0.0 111.414 171.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.54 -44.01 95.45 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.913 -1.117 . . . . 0.0 110.644 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -44.75 68.34 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.048 1.339 . . . . 0.0 111.236 169.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.79 -40.63 97.93 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 176.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -64.09 -44.99 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.744 0.817 . . . . 0.0 110.718 173.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -60.6 -39.37 87.89 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.347 0.659 . . . . 0.0 112.56 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -32.82 63.18 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.378 -0.826 . . . . 0.0 112.126 174.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -36.29 83.38 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 120.121 1.328 . . . . 0.0 112.48 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -21.92 60.46 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.902 -0.499 . . . . 0.0 112.268 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.38 -28.79 14.3 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.638 1.175 . . . . 0.0 113.216 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.5 m -77.55 -28.87 52.0 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -172.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.42 9.32 84.46 Favored Glycine 0 CA--C 1.542 1.771 0 CA-C-N 119.12 0.873 . . . . 0.0 114.629 -172.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -140.76 144.34 35.51 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 127.89 2.476 . . . . 0.0 106.637 169.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.71 158.61 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.651 2.901 . . . . 0.0 114.785 169.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.0 t -115.57 164.92 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.867 2.067 . . . . 0.0 108.204 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -155.99 174.53 33.91 Favored Glycine 0 N--CA 1.465 0.611 0 CA-C-N 120.402 1.456 . . . . 0.0 115.788 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 138.04 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.55 1.14 . . . . 0.0 108.773 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -114.89 125.59 53.82 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.109 2.163 . . . . 0.0 109.299 -169.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -127.26 127.1 43.85 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 110.895 -171.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.5 t -147.19 167.08 25.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.028 1.331 . . . . 0.0 112.053 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.33 -28.02 67.63 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.409 1.083 . . . . 0.0 112.697 173.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 p -71.88 -54.19 10.84 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.034 1.334 . . . . 0.0 112.58 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.66 173.4 13.94 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.356 2.262 . . . . 0.0 110.336 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -136.25 153.36 51.22 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.939 0.896 . . . . 0.0 111.508 169.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.8 ptp85 -158.28 163.21 37.61 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.822 1.249 . . . . 0.0 113.955 -170.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.9 mt -92.91 144.89 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.929 0.891 . . . . 0.0 109.724 170.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 92.0 mtp -134.45 149.79 50.78 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.964 1.706 . . . . 0.0 110.645 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.0 p -141.62 156.07 66.54 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.979 1.711 . . . . 0.0 111.299 -168.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -58.31 -29.99 89.65 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.085 2.523 . . . . 0.0 114.066 169.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 67.4 -68.47 0.25 Allowed Glycine 0 CA--C 1.529 0.942 0 C-N-CA 127.466 2.46 . . . . 0.0 115.496 169.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -135.6 -20.75 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.345 1.858 . . . . 0.0 114.436 -169.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.48 48.01 3.04 Favored Pre-proline 0 N--CA 1.485 1.281 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -169.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -65.82 4.69 0.79 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 123.973 3.115 . . . . 0.0 114.741 178.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.0 m -44.88 -33.79 2.1 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 129.184 2.994 . . . . 0.0 115.573 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -154.04 -51.65 0.1 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.552 1.141 . . . . 0.0 111.749 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.8 t-105 -158.91 125.3 4.58 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.478 1.511 . . . . 0.0 110.468 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -152.65 154.13 34.71 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.234 1.413 . . . . 0.0 111.14 174.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -141.87 151.0 42.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.823 1.249 . . . . 0.0 112.534 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.3 p -159.45 149.54 15.16 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 127.992 2.517 . . . . 0.0 108.12 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.28 140.22 42.77 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.577 2.185 . . . . 0.0 112.813 169.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.74 64.27 2.98 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.272 1.029 . . . . 0.0 110.371 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -131.05 5.65 4.53 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.658 1.583 . . . . 0.0 113.086 -170.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -62.03 -18.21 59.84 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.655 1.182 . . . . 0.0 113.961 176.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -133.85 -33.09 1.07 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.162 1.385 . . . . 0.0 113.026 173.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.82 -11.94 61.05 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 174.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.32 -55.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 129.934 3.294 . . . . 0.0 116.574 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.5 -15.15 0.24 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.778 1.631 . . . . 0.0 113.894 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -62.42 -21.29 65.29 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 120.801 -1.187 . . . . 0.0 114.085 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.0 m -76.65 -2.3 32.02 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.455 1.502 . . . . 0.0 114.735 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -141.22 165.42 27.58 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.107 1.322 . . . . 0.0 112.863 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 41.2 t30 47.73 -52.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 130.362 3.465 . . . . 0.0 119.684 169.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -55.46 -13.68 1.61 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 127.412 2.285 . . . . 0.0 113.442 169.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 28.6 m95 -43.07 -30.26 0.42 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 115.604 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -149.17 154.88 39.81 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.928 1.24 . . . . 0.0 112.972 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -145.62 -19.64 0.47 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -177.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -136.99 16.35 3.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.548 1.539 . . . . 0.0 111.311 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -129.61 156.45 44.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.944 1.698 . . . . 0.0 110.532 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.2 m -125.44 130.65 52.26 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.288 1.835 . . . . 0.0 109.013 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.97 139.3 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.594 1.158 . . . . 0.0 110.06 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 -137.48 122.18 18.64 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.505 1.522 . . . . 0.0 109.357 -176.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.15 145.11 42.1 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.972 1.309 . . . . 0.0 111.994 -169.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -156.62 153.48 24.78 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.364 1.865 . . . . 0.0 110.19 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -75.02 -15.22 22.56 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 CA-C-N 120.347 1.16 . . . . 0.0 113.69 -3.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -61.06 125.57 24.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.202 1.001 . . . . 0.0 111.801 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 134.72 89.61 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 124.183 0.993 . . . . 0.0 112.52 177.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.98 108.64 2.36 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.049 2.5 . . . . 0.0 109.627 172.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -159.51 145.93 16.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.473 1.109 . . . . 0.0 111.851 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.85 48.22 0.46 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.446 1.498 . . . . 0.0 112.618 174.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.8 m -58.31 156.18 10.44 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.903 1.681 . . . . 0.0 113.207 -176.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -67.8 5.09 0.93 Allowed 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -159.45 164.35 20.82 Favored Pre-proline 0 CA--C 1.542 0.649 0 C-N-CA 127.346 2.258 . . . . 0.0 109.889 -176.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.89 149.68 83.13 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 121.407 1.405 . . . . 0.0 110.01 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -94.1 -42.81 8.8 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.039 -0.413 . . . . 0.0 111.987 176.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -73.79 138.53 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.227 1.011 . . . . 0.0 109.194 169.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 85.5 t -136.13 144.94 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.717 0.807 . . . . 0.0 111.772 -176.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.45 118.0 48.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 128.885 2.874 . . . . 0.0 108.072 -173.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.7 mt -82.53 163.41 21.54 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 122.275 1.036 . . . . 0.0 111.952 177.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.88 -13.69 11.99 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -176.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -120.12 9.44 11.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.561 . . . . 0.0 113.308 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.31 9.25 58.12 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 115.788 1.075 . . . . 0.0 115.788 174.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -75.49 136.56 40.63 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.942 1.371 . . . . 0.0 108.178 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.2 mm -130.14 144.69 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.706 1.203 . . . . 0.0 109.551 -172.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.6 p -54.75 133.56 65.44 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 121.656 -0.653 . . . . 0.0 110.931 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.49 98.49 1.18 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.506 2.137 . . . . 0.0 111.466 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 22.4 p90 -124.48 177.28 6.0 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.045 1.738 . . . . 0.0 111.945 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.2 t -140.26 145.57 37.49 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.802 1.241 . . . . 0.0 110.299 172.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 7.7 tp -130.45 92.14 3.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.128 2.171 . . . . 0.0 109.602 -169.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.1 tt -80.75 143.73 32.69 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.962 0.905 . . . . 0.0 109.921 176.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 63.2 mtt -127.31 133.11 50.15 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 126.028 1.731 . . . . 0.0 108.309 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.46 143.49 51.17 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.907 1.283 . . . . 0.0 110.693 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -66.92 109.46 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.764 0.826 . . . . 0.0 110.901 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.37 64.57 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.88 -0.04 75.57 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 125.653 1.597 . . . . 0.0 114.429 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -129.85 -37.45 1.53 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.704 1.201 . . . . 0.0 113.143 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 88.49 30.18 16.82 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 118.515 0.598 . . . . 0.0 114.014 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -141.65 139.67 18.95 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.123 1.369 . . . . 0.0 111.225 -169.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -49.61 144.63 18.93 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.912 3.075 . . . . 0.0 114.182 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.466 HD11 ' HA ' ' A' ' 10' ' ' ASN . 1.5 tm? -130.68 -50.08 1.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 110.603 -169.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.47 162.84 33.48 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.74 1.616 . . . . 0.0 110.174 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 9.4 m -147.99 117.51 7.01 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 123.882 0.873 . . . . 0.0 109.188 176.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.5 mp -92.4 149.51 21.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.8 1.24 . . . . 0.0 109.918 173.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.07 136.45 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.417 1.087 . . . . 0.0 112.056 -169.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 18.0 t -120.62 160.26 23.61 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.905 1.682 . . . . 0.0 111.442 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 82.1 p -137.72 -0.4 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -174.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.34 -11.6 5.8 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.613 1.102 . . . . 0.0 115.004 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.2 p -157.6 158.67 36.0 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.235 -1.156 . . . . 0.0 113.513 -173.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' TRP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 131' ' ' PRO . 29.6 t-105 -60.69 140.11 92.95 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 126.309 1.843 . . . . 0.0 114.991 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 130' ' ' TRP . 42.6 Cg_endo -96.1 176.98 9.71 Favored 'Cis proline' 0 CA--C 1.546 1.114 0 CA-C-N 119.969 1.025 . . . . 0.0 111.281 -11.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.9 mp -69.35 168.14 14.98 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.133 0.968 . . . . 0.0 111.096 169.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -114.71 164.29 14.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.158 1.383 . . . . 0.0 109.434 169.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -140.46 149.83 43.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.362 1.065 . . . . 0.0 112.484 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.1 t -145.62 150.28 36.06 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.149 1.38 . . . . 0.0 111.181 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.85 132.19 46.35 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.781 -0.574 . . . . 0.0 109.478 169.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.91 66.37 0.07 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.472 2.309 . . . . 0.0 115.939 176.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.76 7.81 4.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 175.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -57.74 -31.28 66.32 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 116.31 1.967 . . . . 0.0 116.31 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.9 p -99.09 -6.33 28.59 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -63.64 -35.77 18.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 117.277 2.325 . . . . 0.0 117.277 -169.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo . . . . . 0 C--O 1.25 1.094 0 C-N-CA 124.111 3.207 . . . . 0.0 115.307 177.865 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 . . . . . 0 CA--C 1.541 0.607 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -71.12 -41.11 70.95 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.836 1.198 . . . . 0.0 112.767 176.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 46.4 t -66.96 -45.01 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.693 0.797 . . . . 0.0 109.825 173.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.69 90.83 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.105 0.962 . . . . 0.0 112.512 176.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -63.11 -49.28 75.03 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.749 1.159 . . . . 0.0 111.671 172.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.2 m -57.77 -52.41 65.59 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.136 0.574 . . . . 0.0 110.584 177.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -65.48 -30.75 71.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.685 1.194 . . . . 0.0 113.728 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.35 -48.75 78.43 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.743 1.61 . . . . 0.0 110.778 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -66.41 -38.94 88.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.887 1.275 . . . . 0.0 111.513 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.53 -46.06 87.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.612 0.765 . . . . 0.0 112.191 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.3 m -57.56 -40.08 78.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.857 0.863 . . . . 0.0 111.27 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.06 -44.58 84.11 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.46 -43.51 97.15 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.357 -0.839 . . . . 0.0 111.913 174.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -62.15 -45.56 92.91 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.948 1.699 . . . . 0.0 111.515 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -59.13 -47.46 85.21 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.463 1.105 . . . . 0.0 112.242 170.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.5 m -58.24 -41.56 84.45 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 118.871 0.759 . . . . 0.0 110.725 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.32 -41.02 94.44 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.051 -1.031 . . . . 0.0 113.715 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.23 -32.78 74.5 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.148 -0.97 . . . . 0.0 113.094 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.3 tp -74.08 -35.11 64.2 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.848 1.259 . . . . 0.0 111.602 174.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.53 -46.25 90.75 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.994 -1.066 . . . . 0.0 111.067 169.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 tp -51.98 -47.45 64.85 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.322 1.449 . . . . 0.0 111.262 169.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.43 85.93 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.9 mt -66.05 -47.95 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.411 1.005 . . . . 0.0 110.659 174.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -59.83 -39.24 84.4 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.807 -0.558 . . . . 0.0 112.007 175.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -69.17 -38.72 78.86 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.362 -0.836 . . . . 0.0 112.391 175.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.26 73.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.449 1.022 . . . . 0.0 112.712 174.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.08 -20.41 55.79 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.687 0.676 . . . . 0.0 112.551 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.48 -27.19 14.17 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.613 1.165 . . . . 0.0 113.702 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.7 m -89.83 -14.03 35.28 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -169.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.34 -1.36 81.67 Favored Glycine 0 CA--C 1.542 1.723 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -140.83 149.98 58.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 127.861 2.464 . . . . 0.0 107.25 172.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -45.95 164.67 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 124.305 3.337 . . . . 0.0 115.528 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.8 t -123.12 159.3 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.431 1.893 . . . . 0.0 108.353 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.35 -178.79 32.71 Favored Glycine 0 N--CA 1.465 0.574 0 O-C-N 120.721 -1.237 . . . . 0.0 115.402 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.8 mt -131.27 111.95 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.42 1.088 . . . . 0.0 110.333 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -83.36 78.29 9.66 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.206 1.803 . . . . 0.0 110.269 175.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -64.99 120.36 12.46 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 168.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 t -125.99 -179.6 4.77 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.25 1.42 . . . . 0.0 113.079 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.34 -24.78 68.0 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -169.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.1 m -135.08 -9.72 2.29 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -175.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -161.16 -175.68 5.01 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.959 2.104 . . . . 0.0 109.365 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -136.6 151.48 49.38 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.302 1.041 . . . . 0.0 109.583 169.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -141.08 151.34 43.92 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.2 mm -76.65 137.33 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 169.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.1 mtm -128.89 150.4 50.37 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.049 1.34 . . . . 0.0 111.371 175.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.65 163.28 51.74 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 126.98 2.112 . . . . 0.0 111.261 -168.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -54.49 160.95 6.24 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 124.085 3.19 . . . . 0.0 114.825 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -120.22 -136.35 5.17 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.587 1.089 . . . . 0.0 113.715 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -46.54 -35.79 6.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 126.37 1.868 . . . . 0.0 114.68 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 t -146.45 142.13 17.09 Favored Pre-proline 0 N--CA 1.47 0.572 0 C-N-CA 124.805 1.242 . . . . 0.0 111.696 174.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.6 -10.0 14.59 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.488 2.792 . . . . 0.0 112.55 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 t -71.13 -17.3 62.57 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.057 1.343 . . . . 0.0 114.157 -173.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.62 163.7 33.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.489 1.516 . . . . 0.0 111.611 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.0 t-105 -58.32 112.4 1.55 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.844 1.257 . . . . 0.0 111.911 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.1 tpt85 -157.04 143.18 17.96 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.699 1.599 . . . . 0.0 109.992 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -136.52 153.63 50.96 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.553 1.141 . . . . 0.0 112.81 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.4 t -150.3 140.33 13.86 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 128.079 2.552 . . . . 0.0 108.366 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -51.46 145.32 29.1 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.474 2.116 . . . . 0.0 111.787 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.4 tp -66.44 12.7 0.06 Allowed 'General case' 0 CA--C 1.554 1.134 0 O-C-N 120.576 -1.328 . . . . 0.0 114.185 176.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -64.93 -7.77 12.9 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.998 -1.688 . . . . 0.0 113.576 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -57.46 -25.78 60.23 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.031 1.333 . . . . 0.0 112.122 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -137.21 -42.19 0.57 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.607 1.163 . . . . 0.0 112.964 170.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.35 48.3 1.01 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.014 1.325 . . . . 0.0 111.492 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.31 -34.66 10.88 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.707 1.603 . . . . 0.0 115.099 -169.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -123.92 13.5 9.16 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.743 2.017 . . . . 0.0 113.286 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -133.39 -5.16 2.97 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.242 1.417 . . . . 0.0 113.942 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.0 t -54.88 -34.29 62.83 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.263 1.025 . . . . 0.0 112.819 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -118.91 140.21 50.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.62 1.568 . . . . 0.0 112.506 178.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 23.83 -115.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 127.429 2.292 . . . . 0.0 114.152 -169.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.0 t70 54.41 29.92 11.84 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.351 1.46 . . . . 0.0 113.718 -169.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -115.85 -21.25 9.66 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.972 1.709 . . . . 0.0 113.21 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -141.6 170.65 15.33 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.952 1.301 . . . . 0.0 113.537 -175.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -143.0 8.24 1.65 Allowed 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 169.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.36 9.41 1.08 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 125.053 1.341 . . . . 0.0 114.213 -175.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.96 160.86 23.96 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.414 -1.429 . . . . 0.0 112.097 -169.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.6 m -128.78 134.47 48.4 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 126.759 2.024 . . . . 0.0 108.825 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -104.61 146.98 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 124.292 1.037 . . . . 0.0 110.226 -173.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -138.18 160.9 38.21 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.663 1.985 . . . . 0.0 109.81 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.97 160.84 28.93 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.664 1.186 . . . . 0.0 112.424 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -148.0 130.58 7.8 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.948 2.099 . . . . 0.0 108.284 176.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -79.0 -5.21 37.48 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 CA-C-N 121.671 1.633 . . . . 0.0 113.146 -10.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -65.99 -178.83 0.65 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.177 1.791 . . . . 0.0 112.724 176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.6 138.87 25.44 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 124.485 1.114 . . . . 0.0 112.897 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.72 99.88 1.2 Allowed 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.72 2.947 . . . . 0.0 109.704 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -156.46 154.39 30.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.663 1.185 . . . . 0.0 111.67 -169.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -76.06 53.08 0.76 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.925 1.69 . . . . 0.0 113.51 -171.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 84.0 p -67.38 -12.85 61.25 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.426 1.49 . . . . 0.0 114.119 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.9 25.81 14.98 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.406 1.883 . . . . 0.0 113.2 -175.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -144.18 164.42 29.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 125.419 1.488 . . . . 0.0 110.299 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -64.84 141.22 70.57 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 CA-C-N 120.057 1.056 . . . . 0.0 111.951 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -89.21 -25.83 21.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.931 0.892 . . . . 0.0 110.96 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.5 t -123.98 134.91 65.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.691 1.996 . . . . 0.0 108.324 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.3 t -132.82 145.48 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.972 0.909 . . . . 0.0 111.36 -171.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.0 120.13 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.377 2.671 . . . . 0.0 108.422 -169.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.2 mt -85.54 164.21 17.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.253 1.025 . . . . 0.0 112.058 177.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.02 -13.79 13.22 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -175.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -120.32 9.79 11.1 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.48 1.512 . . . . 0.0 113.354 -177.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.96 9.02 58.71 Favored Glycine 0 CA--C 1.533 1.212 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 174.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.13 136.49 41.09 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.815 1.307 . . . . 0.0 108.438 169.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.21 142.59 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.915 1.286 . . . . 0.0 109.169 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.6 p -54.02 127.31 54.04 Favored Pre-proline 0 N--CA 1.472 0.655 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.232 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.34 122.78 8.98 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.535 2.157 . . . . 0.0 111.423 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.524 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 3.3 p90 -159.03 -179.27 7.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.925 2.09 . . . . 0.0 110.594 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -140.85 99.39 3.6 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 172.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.4 tp -57.73 127.93 34.53 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.369 2.268 . . . . 0.0 109.418 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -125.58 150.53 47.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.059 1.344 . . . . 0.0 110.546 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.3 mtt -133.06 144.74 50.21 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.42 -176.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.61 147.62 43.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.32 1.448 . . . . 0.0 111.317 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -65.86 121.43 15.03 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.982 0.913 . . . . 0.0 110.506 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.62 -18.91 64.41 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 176.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -72.07 -65.51 2.35 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.611 1.1 . . . . 0.0 113.166 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 38.5 p -83.83 -26.1 29.8 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 83.87 -0.1 89.59 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.142 1.353 . . . . 0.0 113.874 -170.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -80.09 145.91 61.91 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-N 118.705 1.253 . . . . 0.0 112.403 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.39 151.24 80.63 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.932 2.421 . . . . 0.0 112.007 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.61 -47.47 1.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.827 1.651 . . . . 0.0 112.619 -169.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 8.0 tp -151.94 156.2 39.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.951 1.3 . . . . 0.0 109.813 -169.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -146.69 139.31 25.11 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.384 1.074 . . . . 0.0 109.149 174.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.0 131.65 56.88 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.134 1.774 . . . . 0.0 108.285 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.9 t -118.95 139.83 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.456 1.502 . . . . 0.0 111.214 -169.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.524 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.7 t -123.21 144.59 49.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.031 1.732 . . . . 0.0 111.255 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.0 m -129.42 8.77 5.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.724 1.21 . . . . 0.0 113.712 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.89 -12.8 4.47 Favored Glycine 0 CA--C 1.537 1.424 0 N-CA-C 115.71 1.044 . . . . 0.0 115.71 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 87.7 p -157.78 159.71 37.05 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.057 1.428 . . . . 0.0 114.128 -173.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 35.0 t-105 -60.67 139.9 92.93 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 127.068 2.147 . . . . 0.0 115.803 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -95.9 179.01 8.47 Favored 'Cis proline' 0 CA--C 1.547 1.168 0 CA-C-N 120.05 1.053 . . . . 0.0 110.828 -11.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -72.3 165.35 24.65 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.15 -0.969 . . . . 0.0 112.251 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -118.71 129.49 55.31 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.891 1.676 . . . . 0.0 111.58 -176.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -92.61 143.96 25.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.375 1.87 . . . . 0.0 112.582 -169.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.3 t -150.39 159.34 44.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.195 1.798 . . . . 0.0 110.924 171.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -78.85 134.45 36.94 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.366 -0.834 . . . . 0.0 109.014 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.18 60.13 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.939 2.096 . . . . 0.0 115.589 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 39.4 ptt180 44.68 27.29 0.24 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.874 2.87 . . . . 0.0 117.405 -176.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -57.94 -30.42 65.95 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 40.7 p -79.87 -15.24 57.75 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 174.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -72.01 -39.3 6.65 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo . . . . . 0 C--O 1.25 1.103 0 C-N-CA 124.297 3.331 . . . . 0.0 115.222 176.047 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -66.11 -41.9 89.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.044 0.937 . . . . 0.0 112.432 171.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.02 -46.83 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 118.381 -0.819 . . . . 0.0 109.409 170.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.91 90.71 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.559 1.072 . . . . 0.0 113.028 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -61.82 -48.72 79.33 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.436 1.016 . . . . 0.0 111.818 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 m -57.66 -47.62 81.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.905 0.482 . . . . 0.0 111.12 176.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.72 -34.25 77.42 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.109 1.764 . . . . 0.0 112.424 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.41 ' HA ' HD11 ' A' ' 80' ' ' LEU . . . -61.82 -46.51 89.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.62 1.1 . . . . 0.0 111.534 169.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.61 -37.47 86.71 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.248 1.019 . . . . 0.0 111.663 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -65.44 -46.57 79.37 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.056 0.942 . . . . 0.0 112.238 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 84.8 m -60.34 -35.06 74.78 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.326 1.05 . . . . 0.0 111.803 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.55 73.4 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.025 1.33 . . . . 0.0 113.48 174.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -44.05 97.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.6 -0.687 . . . . 0.0 111.518 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -59.79 -48.54 81.28 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.6 1.16 . . . . 0.0 111.854 173.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -58.39 -44.6 89.0 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.134 0.879 . . . . 0.0 112.183 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 29.8 m -61.25 -43.03 99.55 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.493 0.588 . . . . 0.0 110.797 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.45 93.67 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.073 -1.017 . . . . 0.0 113.429 172.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.62 76.33 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.123 0.969 . . . . 0.0 112.779 175.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.3 tp -72.94 -34.64 66.69 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.756 1.223 . . . . 0.0 111.537 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.33 -45.33 93.72 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.049 -1.032 . . . . 0.0 110.833 169.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.33 -45.78 55.13 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.869 1.668 . . . . 0.0 111.178 169.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.51 96.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.91 -48.67 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.836 0.744 . . . . 0.0 110.427 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.25 -29.15 69.66 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.572 1.149 . . . . 0.0 113.167 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -87.01 -37.53 17.41 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.068 0.947 . . . . 0.0 113.082 177.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.22 -33.23 71.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.306 1.042 . . . . 0.0 113.623 -177.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 t -74.17 -13.87 60.87 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.6 mt -110.26 -35.96 5.94 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 113.536 -173.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.3 p -70.24 -35.24 73.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.908 1.283 . . . . 0.0 113.703 -177.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.26 0.8 50.84 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.406 1.479 . . . . 0.0 114.699 -175.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -144.67 147.6 36.48 Favored Pre-proline 0 N--CA 1.473 0.68 0 C-N-CA 125.243 1.417 . . . . 0.0 110.08 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -46.78 152.71 1.57 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 122.608 2.205 . . . . 0.0 112.116 167.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.23 160.65 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.417 1.487 . . . . 0.0 108.455 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.66 175.97 28.57 Favored Glycine 0 CA--C 1.522 0.482 0 O-C-N 120.886 -1.134 . . . . 0.0 114.53 -176.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.4 mt -135.72 127.65 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.603 1.161 . . . . 0.0 108.728 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -99.95 130.66 46.15 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.272 1.829 . . . . 0.0 109.587 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -118.61 121.71 40.85 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.055 1.742 . . . . 0.0 107.919 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 p -115.34 -178.47 3.38 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.567 1.147 . . . . 0.0 113.112 -169.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -65.54 -13.54 59.15 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.2 m -139.1 -21.34 0.95 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -170.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -156.65 -172.71 4.17 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.844 1.258 . . . . 0.0 111.495 -178.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p90 -147.64 149.21 32.07 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.3 -0.875 . . . . 0.0 110.28 169.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 67.1 mtt-85 -146.86 145.63 29.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.289 1.435 . . . . 0.0 111.9 -171.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 14.3 mm -73.57 146.65 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.0 mtp -135.86 146.23 47.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.355 1.062 . . . . 0.0 111.483 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.9 m -140.14 165.49 30.21 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.703 1.601 . . . . 0.0 112.358 -169.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -59.79 -31.56 94.17 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.272 2.648 . . . . 0.0 114.642 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 45.33 -83.53 0.01 OUTLIER Glycine 0 CA--C 1.536 1.393 0 C-N-CA 127.719 2.58 . . . . 0.0 116.082 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -62.33 -39.56 93.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.955 1.302 . . . . 0.0 113.196 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.1 t -161.32 136.7 5.7 Favored Pre-proline 0 N--CA 1.478 0.93 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.45 -12.35 3.86 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.75 2.966 . . . . 0.0 112.995 169.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 m -70.21 -16.19 63.03 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -169.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -149.75 165.18 33.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.736 2.014 . . . . 0.0 109.556 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.6 t-105 -49.95 115.64 1.48 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.748 1.219 . . . . 0.0 112.002 178.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -150.55 149.89 30.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.263 1.425 . . . . 0.0 110.404 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -142.18 137.9 31.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.727 0.811 . . . . 0.0 112.72 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.3 t -141.91 135.23 14.3 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 126.964 2.106 . . . . 0.0 108.224 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.86 137.61 45.69 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.868 2.378 . . . . 0.0 111.644 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.1 tp -96.47 127.16 42.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.284 0.634 . . . . 0.0 111.375 -172.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -159.96 -24.25 0.07 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 169.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.22 -18.2 46.84 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -172.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -126.78 16.61 7.45 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.634 1.574 . . . . 0.0 113.097 174.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -129.46 4.08 5.11 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.237 1.815 . . . . 0.0 113.225 176.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.55 -65.19 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 130.389 3.475 . . . . 0.0 116.552 -177.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -152.99 4.89 0.35 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.298 1.839 . . . . 0.0 113.106 -176.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.81 36.37 0.21 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.016 1.726 . . . . 0.0 113.38 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.8 t -140.35 -157.1 0.74 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.049 2.54 . . . . 0.0 108.839 -173.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 43.78 43.81 5.24 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 171.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 56.78 21.81 6.35 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -176.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.09 -16.35 51.66 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 118.931 -2.356 . . . . 0.0 113.918 172.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.5 m0 -66.05 -18.82 65.59 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -170.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -140.44 170.7 15.31 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -172.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.77 15.7 2.32 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.485 1.514 . . . . 0.0 113.392 175.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -146.27 -0.91 0.75 Allowed 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 115.274 1.583 . . . . 0.0 115.274 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 13' ' ' ALA . 27.9 mt -120.58 162.63 19.31 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -168.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.6 t -139.13 131.24 28.03 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 128.442 2.697 . . . . 0.0 106.359 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -106.97 147.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 123.644 0.778 . . . . 0.0 111.183 -169.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -133.38 156.69 47.21 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.513 1.925 . . . . 0.0 109.549 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.12 162.88 31.7 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.06 0.944 . . . . 0.0 111.909 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.52 142.09 11.03 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.897 1.679 . . . . 0.0 110.002 169.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -72.59 -7.76 16.29 Favored 'Cis proline' 0 CA--C 1.546 1.083 0 CA-C-N 120.737 1.299 . . . . 0.0 113.32 -9.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -65.18 175.29 1.68 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.229 1.412 . . . . 0.0 112.073 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.58 142.28 19.0 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.254 1.022 . . . . 0.0 113.027 -174.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.33 91.71 1.11 Allowed 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 124.1 3.2 . . . . 0.0 110.826 177.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -157.38 138.45 13.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 0.0 110.272 -170.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -60.89 86.76 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.408 1.083 . . . . 0.0 112.006 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.7 m -95.69 -2.16 48.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.782 1.633 . . . . 0.0 113.161 -169.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.43 18.39 3.45 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 126.877 2.071 . . . . 0.0 114.449 -177.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -158.43 162.43 26.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 126.876 2.07 . . . . 0.0 109.348 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.28 152.4 75.82 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 CA-C-N 120.178 1.099 . . . . 0.0 110.441 169.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -102.85 -44.58 5.23 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.479 0.312 . . . . 0.0 110.289 170.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.0 t -74.85 132.8 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.864 0.866 . . . . 0.0 109.183 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.2 t -134.37 144.81 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.814 0.846 . . . . 0.0 110.796 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.4 mp -130.45 122.31 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 127.749 2.42 . . . . 0.0 109.46 -169.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.2 mt -87.92 159.75 18.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.997 0.904 . . . . 0.0 111.623 174.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.05 -27.57 63.71 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.127 1.371 . . . . 0.0 114.509 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -84.74 -5.18 59.31 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.088 1.355 . . . . 0.0 113.431 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.39 12.14 61.7 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.217 0.913 . . . . 0.0 114.61 -176.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -76.89 136.38 38.84 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 118.482 1.141 . . . . 0.0 108.734 169.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -130.01 148.32 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.054 1.341 . . . . 0.0 109.431 -172.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 p -51.49 124.06 24.01 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.047 0.939 . . . . 0.0 111.908 169.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -74.03 92.69 0.89 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.151 2.567 . . . . 0.0 111.6 177.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -134.34 -178.09 4.89 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.258 1.823 . . . . 0.0 112.093 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 m -141.68 147.63 37.79 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.665 0.786 . . . . 0.0 111.259 169.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.5 133.01 52.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.993 2.117 . . . . 0.0 108.438 -176.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -122.14 147.19 46.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.119 -176.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 52.3 mtt -123.85 129.5 51.11 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.983 1.313 . . . . 0.0 109.761 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.9 143.6 51.23 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.896 1.678 . . . . 0.0 111.061 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -53.49 124.18 14.15 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.525 1.13 . . . . 0.0 111.566 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.54 -20.6 56.75 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -112.07 -48.62 0.65 Allowed Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.773 1.177 . . . . 0.0 113.214 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.8 m -71.87 -22.02 61.58 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.13 0.965 . . . . 0.0 112.288 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 68.14 35.86 84.26 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.235 0.921 . . . . 0.0 113.49 177.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -133.06 132.72 22.48 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.422 1.489 . . . . 0.0 110.887 -169.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -53.11 145.06 44.32 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 124.051 3.167 . . . . 0.0 115.0 177.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -34.08 4.09 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.736 1.215 . . . . 0.0 111.44 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -154.4 157.58 38.74 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 111.997 -168.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 7.4 m -143.94 147.8 34.46 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.301 1.84 . . . . 0.0 109.403 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.6 mp -119.42 142.17 48.45 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 126.161 1.785 . . . . 0.0 108.784 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 40.0 t -135.11 134.4 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.665 0.786 . . . . 0.0 111.702 -169.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -108.86 161.29 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.958 1.303 . . . . 0.0 112.137 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.5 p -133.78 2.07 3.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.885 1.674 . . . . 0.0 113.766 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 121.56 -8.82 10.1 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.121 1.343 . . . . 0.0 114.503 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.4 p -155.65 159.38 39.54 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 118.59 1.195 . . . . 0.0 113.75 -174.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.8 t-105 -60.9 138.73 93.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.852 2.061 . . . . 0.0 115.732 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.6 175.55 10.3 Favored 'Cis proline' 0 CA--C 1.546 1.11 0 CA-C-N 119.926 1.009 . . . . 0.0 110.717 -11.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.0 154.31 42.11 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 122.203 1.001 . . . . 0.0 110.718 169.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -79.05 168.11 20.12 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.311 1.445 . . . . 0.0 109.047 169.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -144.42 130.63 19.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.546 1.538 . . . . 0.0 109.968 -177.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.3 t -151.83 160.83 43.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.956 1.302 . . . . 0.0 112.173 -171.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.33 131.09 35.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.412 -0.805 . . . . 0.0 109.142 169.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.27 61.08 0.55 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.203 1.801 . . . . 0.0 115.541 173.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 57.29 12.37 1.37 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.997 2.519 . . . . 0.0 117.291 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -55.63 -35.05 65.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.575 2.065 . . . . 0.0 116.575 -169.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -80.59 -15.64 56.13 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -66.65 133.93 94.23 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.075 0.95 . . . . 0.0 112.182 -169.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 C--O 1.249 1.062 0 C-N-CA 123.446 2.764 . . . . 0.0 113.17 178.334 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 CA--C 1.544 0.741 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -72.82 -38.36 67.18 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.985 -1.072 . . . . 0.0 113.033 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.83 -38.9 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.94 170.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.73 -44.03 97.27 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.317 0.962 . . . . 0.0 112.422 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -57.75 -46.33 84.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.085 1.311 . . . . 0.0 111.843 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.8 m -61.41 -57.11 13.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.615 0.766 . . . . 0.0 111.255 178.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -63.11 -34.39 77.51 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.145 1.378 . . . . 0.0 113.076 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.65 -52.76 63.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.692 1.587 . . . . 0.0 111.719 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -64.22 -41.87 96.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.93 -54.25 44.49 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.307 1.443 . . . . 0.0 112.417 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.3 m -60.6 -36.43 78.55 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.892 1.277 . . . . 0.0 111.414 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.91 86.9 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.5 99.29 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.433 -0.792 . . . . 0.0 111.915 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -61.39 -46.32 90.67 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 111.858 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -62.73 -41.42 99.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.473 0.709 . . . . 0.0 112.107 173.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.1 m -59.38 -41.55 89.59 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.1 0.863 . . . . 0.0 111.322 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -40.65 96.05 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.77 -1.206 . . . . 0.0 113.399 172.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.68 -30.98 71.75 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 121.144 -0.972 . . . . 0.0 113.234 174.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.0 tp -72.1 -34.52 68.7 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.39 1.076 . . . . 0.0 111.84 172.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.18 -46.11 90.39 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.058 -1.026 . . . . 0.0 111.467 169.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.9 tp -53.98 -46.83 71.81 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.082 1.353 . . . . 0.0 111.982 170.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.45 -43.67 88.92 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 175.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.33 -46.62 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.805 0.842 . . . . 0.0 110.981 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -31.28 69.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.924 0.89 . . . . 0.0 112.931 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.9 mtt-85 -80.28 -37.98 31.73 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.24 1.016 . . . . 0.0 113.483 172.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.93 -34.47 78.18 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.524 1.056 . . . . 0.0 113.369 -175.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.1 t -70.29 -20.18 63.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.94 -31.25 9.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.199 1.4 . . . . 0.0 114.336 -174.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.7 m -82.13 -14.19 56.09 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.81 -3.94 81.51 Favored Glycine 0 CA--C 1.54 1.632 0 C-N-CA 124.22 0.914 . . . . 0.0 115.069 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -139.99 151.84 66.21 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 128.399 2.68 . . . . 0.0 106.765 170.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -45.63 166.65 0.06 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.358 3.372 . . . . 0.0 115.871 169.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -123.22 161.22 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 126.283 1.833 . . . . 0.0 108.235 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -165.28 -175.56 36.04 Favored Glycine 0 N--CA 1.469 0.889 0 CA-C-N 120.698 1.59 . . . . 0.0 115.964 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -127.41 122.54 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.783 1.233 . . . . 0.0 110.886 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -83.4 68.88 9.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.346 1.858 . . . . 0.0 111.322 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -59.65 119.95 8.56 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.466 -0.771 . . . . 0.0 110.219 169.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 84.1 p -141.33 13.52 2.18 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -169.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.76 -47.28 0.26 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.693 2.797 . . . . 0.0 115.169 -174.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.7 m -69.27 -26.95 65.01 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.63 1.172 . . . . 0.0 112.611 171.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.47 166.63 31.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.425 1.89 . . . . 0.0 111.043 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -155.96 99.39 1.97 Allowed 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.915 -0.491 . . . . 0.0 111.558 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -142.42 161.69 37.39 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -169.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.1 mm -71.47 142.52 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.528 1.131 . . . . 0.0 111.213 -171.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 81.0 mtp -128.4 146.67 50.72 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.796 1.638 . . . . 0.0 110.17 169.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 m -133.7 158.86 74.52 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 125.922 1.689 . . . . 0.0 111.26 -170.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -52.39 144.84 38.66 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.417 2.745 . . . . 0.0 115.503 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -101.62 -151.24 24.31 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 125.513 1.53 . . . . 0.0 113.087 175.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -55.42 -23.7 26.36 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.2 p -133.27 65.5 72.93 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 119.44 1.018 . . . . 0.0 113.204 -169.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -63.09 -17.19 58.93 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 123.04 2.493 . . . . 0.0 113.272 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -59.59 -15.36 18.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.427 1.491 . . . . 0.0 114.008 169.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.85 -87.39 0.2 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.62 1.168 . . . . 0.0 111.947 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -162.88 110.08 1.23 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.435 1.094 . . . . 0.0 111.874 -171.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.58 151.29 29.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.211 1.004 . . . . 0.0 110.11 169.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -138.69 150.5 46.26 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -171.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.8 t -143.4 138.96 15.96 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 126.957 2.103 . . . . 0.0 108.686 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.93 145.82 90.63 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.592 2.194 . . . . 0.0 111.304 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.42 45.46 0.23 Allowed 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -170.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -58.01 -20.76 41.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 119.635 -1.915 . . . . 0.0 113.841 172.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -59.42 -18.84 42.56 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.245 1.018 . . . . 0.0 113.686 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -130.69 -35.27 1.47 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.2 1.0 . . . . 0.0 113.498 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.13 -8.19 59.29 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 177.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.14 -60.29 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 129.436 3.095 . . . . 0.0 116.158 -173.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -148.03 -0.55 0.6 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.431 1.892 . . . . 0.0 112.898 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -92.23 0.49 57.46 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.674 -1.266 . . . . 0.0 113.415 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.2 p -64.57 13.89 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 128.456 2.702 . . . . 0.0 117.28 -172.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -154.44 42.82 0.51 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.557 1.543 . . . . 0.0 111.717 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -136.59 163.2 31.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.562 1.545 . . . . 0.0 112.878 -173.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -72.7 -177.42 2.3 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.782 0.833 . . . . 0.0 110.78 168.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -120.45 -6.83 9.77 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -150.64 -168.66 3.17 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -168.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -125.22 2.67 7.85 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.458 1.903 . . . . 0.0 114.382 -175.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -150.12 -4.33 0.36 Allowed 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -169.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.4 mt -105.84 167.91 9.47 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.707 -1.246 . . . . 0.0 113.139 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.7 t -140.76 136.59 32.68 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.427 2.291 . . . . 0.0 107.83 169.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.72 145.36 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.47 1.108 . . . . 0.0 111.272 -169.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -137.76 157.56 46.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.239 1.816 . . . . 0.0 110.142 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.508 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.8 tt -151.22 146.01 25.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.9 0.88 . . . . 0.0 112.089 -171.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.508 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.2 pm0 -151.69 150.88 27.44 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.579 1.552 . . . . 0.0 111.125 169.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -80.04 -13.12 35.62 Favored 'Cis proline' 0 CA--C 1.543 0.943 0 CA-C-N 120.198 1.107 . . . . 0.0 114.451 -0.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -64.19 144.23 57.29 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.948 0.88 . . . . 0.0 113.234 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -62.49 128.87 92.08 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.539 1.536 . . . . 0.0 112.008 170.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.59 57.58 6.15 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 123.768 2.979 . . . . 0.0 109.673 169.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.39 150.0 26.45 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.039 1.336 . . . . 0.0 113.369 -169.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -74.17 47.98 0.3 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.859 1.664 . . . . 0.0 112.579 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.1 m -67.96 -5.59 17.9 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.942 1.697 . . . . 0.0 115.383 -172.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 56.31 27.83 12.47 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 126.157 1.783 . . . . 0.0 113.516 -174.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -146.9 163.12 30.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 109.3 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.75 147.54 85.79 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 CA-C-N 120.085 1.066 . . . . 0.0 111.867 169.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -95.3 -50.47 5.01 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.686 1.194 . . . . 0.0 109.806 170.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 68.3 t -89.66 136.4 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.371 1.468 . . . . 0.0 108.15 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 48.8 t -135.16 143.57 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-O 122.147 0.975 . . . . 0.0 111.947 -171.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -117.19 111.03 33.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 128.582 2.753 . . . . 0.0 107.639 -176.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.15 153.07 36.48 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.134 0.973 . . . . 0.0 109.81 177.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.82 -21.93 44.94 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.28 -11.4 59.9 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.275 1.43 . . . . 0.0 113.573 176.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.48 42.67 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.499 1.047 . . . . 0.0 114.187 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.69 147.44 29.58 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.981 1.312 . . . . 0.0 108.103 173.668 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -121.97 150.88 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.693 0.797 . . . . 0.0 110.585 -168.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.3 p -56.78 130.52 78.18 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.693 169.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -74.97 134.08 17.42 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.34 2.027 . . . . 0.0 112.201 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.461 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 14.5 p90 -163.92 177.28 8.68 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.693 1.997 . . . . 0.0 111.346 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.4 p -138.54 148.49 44.31 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.015 0.912 . . . . 0.0 110.646 169.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 tp -135.81 130.19 33.6 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.835 2.054 . . . . 0.0 108.089 -169.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -121.2 150.25 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.007 1.323 . . . . 0.0 110.363 -173.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 55.3 mtt -127.53 139.66 52.63 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 125.561 1.545 . . . . 0.0 108.669 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -136.83 151.39 49.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.293 1.437 . . . . 0.0 111.11 -177.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -61.73 119.8 9.41 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.365 1.066 . . . . 0.0 109.685 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.1 -19.4 61.42 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -174.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -101.66 -45.02 1.86 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 124.073 0.844 . . . . 0.0 113.609 -177.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.6 p -80.29 -27.82 38.42 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.707 1.254 . . . . 0.0 112.858 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 79.75 0.86 85.99 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 125.119 1.342 . . . . 0.0 113.928 -172.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -75.9 138.42 69.45 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 118.564 1.182 . . . . 0.0 111.638 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.25 154.59 72.86 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.566 2.177 . . . . 0.0 111.798 175.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.25 -51.32 1.19 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.983 1.713 . . . . 0.0 112.06 -169.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.82 153.12 40.55 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 126.847 2.059 . . . . 0.0 108.426 -169.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 4.9 m -143.97 136.84 27.28 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.539 0.736 . . . . 0.0 109.506 172.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.1 mp -116.55 143.78 45.18 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.819 2.448 . . . . 0.0 108.096 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 24.0 t -141.44 134.1 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.901 0.48 . . . . 0.0 111.911 -171.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.461 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.7 t -112.72 114.64 27.31 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.943 1.697 . . . . 0.0 110.305 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.4 p -75.34 -13.2 60.4 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.935 1.294 . . . . 0.0 114.296 174.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 128.21 0.62 6.36 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.414 1.483 . . . . 0.0 114.339 -175.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 19.5 m -156.56 156.06 32.97 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.428 -1.631 . . . . 0.0 112.996 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 30.3 t-105 -60.09 140.15 90.87 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 125.939 1.696 . . . . 0.0 115.344 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -94.29 176.55 12.33 Favored 'Cis proline' 0 CA--C 1.546 1.089 0 CA-C-N 119.932 1.011 . . . . 0.0 110.751 -11.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.1 mp -67.87 149.52 49.73 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.069 -1.019 . . . . 0.0 110.746 169.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -77.87 170.7 16.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.982 1.313 . . . . 0.0 110.282 170.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -140.01 144.45 36.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.781 1.632 . . . . 0.0 111.394 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.7 t -153.42 151.55 30.02 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.889 1.275 . . . . 0.0 111.7 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.88 134.22 50.48 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.588 -0.695 . . . . 0.0 109.841 170.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.68 67.87 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 127.423 2.289 . . . . 0.0 116.579 171.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.3 mtm105 55.7 19.65 3.51 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.27 -17.52 12.24 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -177.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 8.3 t -134.09 28.34 3.8 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.022 1.329 . . . . 0.0 113.334 169.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.66 71.23 71.03 Favored Pre-proline 0 N--CA 1.481 1.12 0 C-N-CA 125.282 1.433 . . . . 0.0 110.677 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo . . . . . 0 C--O 1.251 1.167 1 C-N-CA 125.507 4.138 . . . . 0.0 116.048 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.58 -40.13 80.66 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.107 0.867 . . . . 0.0 112.316 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.46 -46.4 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.253 0.621 . . . . 0.0 109.957 174.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.22 87.38 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.731 0.696 . . . . 0.0 112.37 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -63.63 -46.42 85.76 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.204 0.911 . . . . 0.0 112.219 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.6 m -56.72 -49.77 74.19 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.932 175.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -67.47 -28.57 67.97 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.001 -1.0 . . . . 0.0 113.615 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.52 -48.09 78.99 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 120.711 1.596 . . . . 0.0 111.37 171.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -67.74 -40.64 84.14 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.829 1.252 . . . . 0.0 111.431 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.75 -38.65 80.28 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.697 0.799 . . . . 0.0 113.038 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.5 m -69.71 -34.44 73.9 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 120.117 -1.614 . . . . 0.0 111.853 175.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.65 91.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 170.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.29 92.94 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 112.06 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -64.49 -45.08 88.84 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.016 0.926 . . . . 0.0 112.328 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -62.76 -40.35 97.0 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.195 0.598 . . . . 0.0 112.342 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -60.86 -44.08 97.49 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.796 0.726 . . . . 0.0 110.795 175.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.75 98.29 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.686 -1.259 . . . . 0.0 113.391 172.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.49 76.15 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.14 -0.975 . . . . 0.0 113.097 175.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.1 tp -73.13 -31.74 64.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.439 1.095 . . . . 0.0 111.818 173.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -62.97 -44.31 96.39 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.935 -1.103 . . . . 0.0 110.864 169.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.15 -44.64 67.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.376 1.47 . . . . 0.0 111.321 169.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.28 97.15 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.2 mt -64.14 -45.0 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.202 1.001 . . . . 0.0 111.099 174.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.43 -43.52 75.44 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.803 0.841 . . . . 0.0 112.1 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.73 -31.77 61.92 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 178.044 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.8 89.7 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.414 1.007 . . . . 0.0 113.191 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -76.08 -24.26 55.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.12 -31.11 13.7 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -174.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.2 p -89.5 -14.52 35.07 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -169.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.23 6.53 78.27 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 170.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.62 151.71 54.51 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.987 2.115 . . . . 0.0 107.596 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -46.88 149.31 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 121.98 1.787 . . . . 0.0 111.652 167.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.19 164.93 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.323 1.849 . . . . 0.0 108.486 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.29 -178.68 30.68 Favored Glycine 0 C--N 1.332 0.308 0 O-C-N 120.762 -1.211 . . . . 0.0 115.404 -174.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.6 mt -135.6 120.88 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.564 1.146 . . . . 0.0 108.543 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -89.97 141.89 28.23 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 126.156 1.783 . . . . 0.0 110.861 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -140.07 130.23 25.06 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.137 1.775 . . . . 0.0 109.449 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 t -132.55 179.66 6.0 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.233 1.413 . . . . 0.0 111.039 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -61.85 -14.95 38.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -169.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 -8.42 0.92 Allowed 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 -178.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.5 164.52 36.08 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.778 1.172 . . . . 0.0 113.248 -177.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -149.67 156.22 41.52 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.269 1.828 . . . . 0.0 112.006 -175.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -161.26 148.0 14.73 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.727 1.611 . . . . 0.0 111.342 -175.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.9 mm -68.23 147.68 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 124.411 1.085 . . . . 0.0 109.566 172.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 44.7 mtp -135.75 150.67 49.58 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.474 -1.391 . . . . 0.0 112.466 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 9.4 m -144.06 168.03 13.67 Favored Pre-proline 0 N--CA 1.478 0.969 0 C-N-CA 126.219 1.808 . . . . 0.0 111.736 -169.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -57.53 -33.74 96.95 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.821 2.347 . . . . 0.0 114.089 171.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.46 -50.27 0.61 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 127.47 2.462 . . . . 0.0 116.673 170.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -137.72 -26.52 0.96 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.342 1.457 . . . . 0.0 114.578 -170.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.0 t -148.84 74.94 10.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 123.8 0.84 . . . . 0.0 112.646 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -63.35 -11.5 25.92 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.996 2.464 . . . . 0.0 113.624 170.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.2 m -60.08 -16.89 35.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.538 1.935 . . . . 0.0 114.662 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.01 171.01 15.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.133 1.773 . . . . 0.0 110.472 175.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.3 t-105 -62.8 112.39 2.52 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.366 -0.834 . . . . 0.0 111.145 173.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.457 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 4.6 tpm_? -150.65 157.29 42.8 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.852 1.261 . . . . 0.0 110.98 174.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.457 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 85.4 m95 -139.19 138.46 36.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.207 1.403 . . . . 0.0 111.945 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.77 138.86 17.57 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 126.966 2.106 . . . . 0.0 107.795 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.08 128.74 22.49 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.84 2.36 . . . . 0.0 111.183 175.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.3 tp -76.17 78.8 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.366 1.066 . . . . 0.0 111.133 -176.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -91.3 5.46 49.12 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.32 1.048 . . . . 0.0 112.24 171.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -50.11 110.54 0.41 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.728 2.011 . . . . 0.0 111.966 173.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.0 t70 57.95 -29.71 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.533 2.733 . . . . 0.0 116.385 -171.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 72' ' ' SER . . . -68.38 -18.29 64.43 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.346 1.859 . . . . 0.0 113.644 175.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.73 -178.01 0.14 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.329 2.652 . . . . 0.0 115.653 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -72.8 23.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.967 1.707 . . . . 0.0 114.619 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.31 7.18 5.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.896 2.078 . . . . 0.0 111.216 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.401 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 73.3 p -79.83 -23.53 41.96 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.357 1.463 . . . . 0.0 114.084 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -74.08 123.19 23.93 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.248 1.019 . . . . 0.0 109.207 169.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -147.43 -179.48 6.88 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.098 0.959 . . . . 0.0 112.801 -169.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.91 25.51 10.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.05 2.14 . . . . 0.0 112.579 -177.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER 58.17 -44.66 0.05 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 130.131 3.372 . . . . 0.0 118.413 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -156.55 -167.91 2.54 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.334 0.97 . . . . 0.0 113.409 -169.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -128.09 -14.14 4.97 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.785 2.034 . . . . 0.0 113.121 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -120.42 5.03 10.69 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.59 1.556 . . . . 0.0 111.904 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -139.26 141.63 37.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.531 1.532 . . . . 0.0 110.064 -169.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 88.9 p -137.14 154.91 50.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.678 1.991 . . . . 0.0 111.39 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.07 147.6 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.107 1.363 . . . . 0.0 112.173 -169.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -139.68 162.28 35.49 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.898 2.079 . . . . 0.0 110.838 170.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.2 mt -141.14 155.95 46.02 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.592 1.157 . . . . 0.0 113.932 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.69 155.14 22.18 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.893 2.077 . . . . 0.0 110.325 169.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.13 -9.16 18.38 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 CA-C-N 120.469 1.203 . . . . 0.0 113.207 -9.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.16 172.01 1.59 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.613 1.565 . . . . 0.0 113.361 173.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -126.31 121.66 23.81 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.368 1.867 . . . . 0.0 110.932 -170.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.5 98.3 0.94 Allowed 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.698 2.265 . . . . 0.0 110.475 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -154.35 157.23 38.27 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.483 1.513 . . . . 0.0 111.301 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -70.52 47.0 0.09 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 128.219 2.608 . . . . 0.0 114.358 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.6 t -65.05 160.96 19.8 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.101 2.16 . . . . 0.0 114.303 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -63.81 -13.79 47.4 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.628 1.571 . . . . 0.0 112.727 169.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -131.04 162.78 53.52 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.271 1.428 . . . . 0.0 112.571 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -70.81 164.56 35.13 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.179 2.586 . . . . 0.0 112.416 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -95.57 -21.94 17.94 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.619 1.568 . . . . 0.0 112.398 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.1 t -114.11 143.26 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.547 1.139 . . . . 0.0 108.875 169.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.2 t -136.18 137.75 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 110.326 -178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -125.25 117.97 51.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 128.679 2.791 . . . . 0.0 106.925 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.15 148.58 35.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.385 0.612 . . . . 0.0 110.224 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.9 -22.79 60.16 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -70.02 -22.82 63.07 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.08 1.752 . . . . 0.0 113.458 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 104.09 5.13 44.17 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.98 1.276 . . . . 0.0 115.056 -179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.554 ' C ' HD12 ' A' ' 105' ' ' ILE . 9.1 pt20 -90.55 154.53 19.54 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.81 1.644 . . . . 0.0 109.869 169.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.554 HD12 ' C ' ' A' ' 104' ' ' GLN . 1.2 mp -129.76 142.7 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 124.696 1.198 . . . . 0.0 109.605 -169.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t -56.17 140.43 70.98 Favored Pre-proline 0 N--CA 1.477 0.875 0 C-N-CA 123.541 0.736 . . . . 0.0 112.642 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -64.73 131.18 28.45 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.765 2.31 . . . . 0.0 112.601 169.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.435 ' CZ ' HD21 ' A' ' 132' ' ' LEU . 26.1 p90 -161.52 173.57 14.63 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.785 1.634 . . . . 0.0 111.364 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.3 t -134.28 135.55 42.94 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.07 0.948 . . . . 0.0 110.194 169.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.1 tp -128.64 116.0 18.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 128.06 2.544 . . . . 0.0 108.467 -169.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -105.35 147.06 28.58 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.752 1.221 . . . . 0.0 110.444 -173.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 51.1 mtt -128.38 130.56 47.86 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.849 1.66 . . . . 0.0 109.753 -176.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -134.26 152.29 51.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.773 1.229 . . . . 0.0 112.29 -169.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -64.93 110.4 2.43 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.116 1.367 . . . . 0.0 110.528 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.56 -15.83 59.12 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.69 -20.49 59.75 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.721 1.153 . . . . 0.0 114.384 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -132.03 -21.28 2.4 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.987 1.393 . . . . 0.0 114.424 -171.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 86.78 -1.09 86.88 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 125.599 1.571 . . . . 0.0 114.4 -176.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -83.97 131.51 51.2 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.583 1.191 . . . . 0.0 112.517 -171.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 143.47 40.48 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.531 2.821 . . . . 0.0 113.568 169.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.11 -44.66 1.15 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.686 1.594 . . . . 0.0 112.151 -172.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 tt -149.94 155.21 39.58 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.833 1.653 . . . . 0.0 108.172 -178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 85.5 m -144.04 151.11 39.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.233 -1.542 . . . . 0.0 109.505 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 78.1 mt -128.11 133.59 49.03 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 127.295 2.238 . . . . 0.0 108.323 -169.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.5 t -133.58 135.92 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 122.982 0.513 . . . . 0.0 111.995 -169.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 34.0 t -119.41 141.0 49.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.945 1.698 . . . . 0.0 110.443 175.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -127.94 2.28 5.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.193 1.397 . . . . 0.0 113.833 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 152.59 -20.14 0.8 Allowed Glycine 0 CA--C 1.535 1.317 0 N-CA-C 115.852 1.101 . . . . 0.0 115.852 175.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 4.9 t -156.26 165.27 36.87 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.771 1.785 . . . . 0.0 114.345 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 -63.86 143.66 98.1 Favored Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 127.738 2.415 . . . . 0.0 115.333 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -91.44 177.26 15.84 Favored 'Cis proline' 0 CA--C 1.546 1.102 0 CA-C-N 119.479 0.85 . . . . 0.0 110.472 -11.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.435 HD21 ' CZ ' ' A' ' 108' ' ' PHE . 6.6 mp -68.3 156.26 38.07 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.061 -1.024 . . . . 0.0 111.66 169.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -101.98 129.02 48.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.445 1.498 . . . . 0.0 110.858 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -84.58 149.62 25.76 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.844 1.258 . . . . 0.0 112.048 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.0 t -149.77 146.17 27.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.028 1.731 . . . . 0.0 109.623 169.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.28 136.49 42.64 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.097 -1.002 . . . . 0.0 109.814 170.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 61.07 0.11 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.365 2.266 . . . . 0.0 115.427 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 11.6 ptm180 44.7 27.95 0.3 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.128 2.571 . . . . 0.0 117.763 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.76 -34.57 65.33 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.14 -4.1 58.56 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 174.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.37 48.67 0.51 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.25 1.42 . . . . 0.0 114.612 -170.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo . . . . . 0 C--O 1.249 1.058 0 C-N-CA 123.501 2.8 . . . . 0.0 113.173 179.555 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 . . . . . 0 CA--C 1.546 0.809 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -76.92 -3.72 40.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.035 1.334 . . . . 0.0 114.425 175.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.3 t -129.54 -35.67 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 126.021 1.729 . . . . 0.0 111.696 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.64 73.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.719 1.208 . . . . 0.0 113.563 -173.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -60.01 -52.31 65.92 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.591 1.087 . . . . 0.0 111.919 174.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.9 m -60.08 -44.45 94.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.985 0.914 . . . . 0.0 111.386 177.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -33.92 76.11 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.268 1.027 . . . . 0.0 112.866 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.07 -48.78 78.7 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.872 1.215 . . . . 0.0 111.302 170.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -62.47 -38.34 89.47 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.523 1.129 . . . . 0.0 111.913 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.22 -50.34 68.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.09 1.356 . . . . 0.0 111.932 170.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.8 m -62.52 -32.94 73.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.549 1.14 . . . . 0.0 111.389 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.8 80.22 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.596 1.158 . . . . 0.0 113.292 170.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.3 95.29 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.462 -0.774 . . . . 0.0 111.736 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.99 -47.37 86.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.111 1.364 . . . . 0.0 112.058 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.59 -42.2 98.52 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.698 0.799 . . . . 0.0 112.458 171.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 59.6 m -59.29 -40.79 87.26 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.558 -0.714 . . . . 0.0 111.283 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.99 92.52 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.808 -1.183 . . . . 0.0 113.374 172.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.19 -33.73 76.45 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.202 -0.936 . . . . 0.0 112.915 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -70.37 -35.26 73.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.554 1.142 . . . . 0.0 112.147 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.62 -44.32 96.58 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.076 -1.015 . . . . 0.0 111.723 170.418 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.2 tp -54.11 -46.48 72.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.148 1.379 . . . . 0.0 111.534 170.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.02 96.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.3 mt -62.51 -46.53 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.261 0.937 . . . . 0.0 110.806 173.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.38 -36.59 78.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.463 0.705 . . . . 0.0 112.599 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -73.69 -30.67 63.02 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.04 0.936 . . . . 0.0 113.14 174.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.05 -39.77 90.41 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.971 1.259 . . . . 0.0 114.083 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -68.23 -29.04 67.77 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.675 -0.641 . . . . 0.0 112.121 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.1 mt -79.87 -33.77 39.75 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.025 1.33 . . . . 0.0 113.055 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.8 m -75.39 -22.57 57.36 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -173.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.89 9.79 71.37 Favored Glycine 0 CA--C 1.541 1.706 0 C-N-CA 123.74 0.686 . . . . 0.0 114.434 -176.441 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -151.15 150.64 27.79 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 128.402 2.681 . . . . 0.0 107.592 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -47.66 149.95 4.5 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.508 2.139 . . . . 0.0 112.741 168.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -116.17 165.31 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 126.913 2.085 . . . . 0.0 108.714 -175.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -150.59 175.42 29.62 Favored Glycine 0 CA--C 1.52 0.371 0 O-C-N 121.024 -1.047 . . . . 0.0 115.508 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.6 mt -132.67 120.1 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 124.858 1.263 . . . . 0.0 108.316 178.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -81.86 146.03 30.06 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.306 1.442 . . . . 0.0 110.771 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -142.35 138.3 31.13 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.461 1.905 . . . . 0.0 110.587 174.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.8 p -129.6 -177.61 4.34 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.661 1.584 . . . . 0.0 112.09 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.09 -15.6 14.87 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.1 p -142.61 -11.06 0.81 Allowed 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.466 2.025 . . . . 0.0 116.466 -172.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -150.73 172.13 16.06 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.117 1.326 . . . . 0.0 113.816 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -141.72 158.61 43.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.136 1.774 . . . . 0.0 110.849 171.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -158.51 161.92 37.41 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 124.064 0.945 . . . . 0.0 112.916 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.7 mm -80.08 145.05 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.563 1.145 . . . . 0.0 108.849 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 70.2 mtp -135.81 143.38 45.14 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.209 1.003 . . . . 0.0 111.636 175.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.45 166.25 20.92 Favored Pre-proline 0 N--CA 1.483 1.192 0 C-N-CA 126.223 1.809 . . . . 0.0 111.177 -169.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.63 163.4 24.49 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.725 2.284 . . . . 0.0 113.285 171.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.41 -84.37 0.09 OUTLIER Glycine 0 N--CA 1.472 1.059 0 C-N-CA 123.86 0.743 . . . . 0.0 114.292 176.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 10.8 mmpt? -61.41 -31.31 71.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.712 0.805 . . . . 0.0 113.013 -176.476 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.7 t -158.0 140.67 10.6 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 124.456 1.103 . . . . 0.0 111.37 169.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -81.93 5.17 6.49 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 124.055 3.17 . . . . 0.0 112.52 169.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.2 m -62.56 -27.9 69.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -171.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -159.58 -49.74 0.05 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -148.23 -74.93 0.18 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -169.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -8.64 83.02 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 129.261 3.024 . . . . 0.0 116.454 -169.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -66.3 161.02 23.27 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.486 1.514 . . . . 0.0 114.693 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 41.4 t -140.36 142.34 29.16 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 128.262 2.625 . . . . 0.0 107.626 174.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.6 43.15 0.63 Allowed 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.854 3.702 . . . . 0.0 113.172 173.192 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.6 tp 52.92 -90.01 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.395 2.678 . . . . 0.0 112.665 -169.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 51.31 12.96 0.16 Allowed 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -66.61 -23.39 66.17 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.64 -1.287 . . . . 0.0 113.394 173.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -141.02 -38.96 0.41 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.753 1.621 . . . . 0.0 111.411 172.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 40.06 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.337 1.855 . . . . 0.0 112.579 169.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.88 -25.04 0.26 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 128.982 2.913 . . . . 0.0 118.787 -168.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -140.48 18.5 2.38 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.923 1.289 . . . . 0.0 111.76 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -146.03 18.38 1.42 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.756 1.223 . . . . 0.0 114.256 -169.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.4 p -68.28 -35.48 77.92 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.911 -1.118 . . . . 0.0 112.539 171.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -68.92 119.45 13.27 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.177 1.391 . . . . 0.0 111.229 170.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -138.14 179.94 6.15 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.009 1.724 . . . . 0.0 111.249 -170.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -136.91 178.74 6.84 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.817 2.047 . . . . 0.0 110.127 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -144.03 -46.79 0.27 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.42 163.24 21.29 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -169.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -143.03 -17.67 0.66 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.115 1.366 . . . . 0.0 114.445 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -132.06 14.87 4.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.649 1.58 . . . . 0.0 112.317 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.5 mt -118.87 162.42 18.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.538 1.135 . . . . 0.0 113.613 -175.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.8 t -138.23 133.87 33.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 128.008 2.523 . . . . 0.0 107.385 169.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.21 144.05 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 111.081 -169.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -137.79 149.78 46.67 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.99 1.716 . . . . 0.0 110.226 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.6 mt -126.72 151.82 47.65 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.419 1.088 . . . . 0.0 112.069 -172.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -143.61 128.0 9.45 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.654 1.582 . . . . 0.0 110.016 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -79.1 -3.99 37.06 Favored 'Cis proline' 0 CA--C 1.547 1.169 0 CA-C-N 120.544 1.23 . . . . 0.0 113.36 -9.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -62.26 157.39 19.67 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -169.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -89.2 124.11 65.54 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 126.849 2.06 . . . . 0.0 109.968 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.23 81.59 2.42 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.465 2.777 . . . . 0.0 110.962 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -152.66 149.17 28.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.958 1.303 . . . . 0.0 112.529 -171.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -80.73 54.63 2.17 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.111 -0.993 . . . . 0.0 112.574 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 m -70.89 31.36 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.749 2.42 . . . . 0.0 115.305 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 58.68 15.97 4.06 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.017 2.127 . . . . 0.0 114.575 -172.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -149.22 162.38 29.11 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 125.539 1.536 . . . . 0.0 111.634 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.23 159.59 40.37 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.552 2.168 . . . . 0.0 110.668 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -85.54 -54.49 4.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.793 0.837 . . . . 0.0 109.895 171.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.6 t -83.03 137.73 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.598 1.159 . . . . 0.0 109.254 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 78.8 t -130.5 142.6 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-O 121.621 0.724 . . . . 0.0 110.754 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -128.66 123.66 59.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 128.147 2.579 . . . . 0.0 109.343 -169.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.9 mt -80.77 159.52 25.15 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 111.452 170.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.11 -24.54 67.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.422 1.089 . . . . 0.0 113.636 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.16 -10.04 59.31 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.856 1.663 . . . . 0.0 113.502 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.04 4.56 59.98 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.603 1.097 . . . . 0.0 114.988 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -72.36 141.56 48.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.637 1.218 . . . . 0.0 109.042 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -130.73 153.36 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.938 1.295 . . . . 0.0 109.966 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.8 p -49.5 120.48 10.61 Favored Pre-proline 0 N--CA 1.473 0.686 0 C-N-CA 124.767 1.227 . . . . 0.0 111.76 169.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.9 76.67 3.66 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.824 3.016 . . . . 0.0 111.901 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -115.88 -178.53 3.42 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.994 1.718 . . . . 0.0 112.797 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.2 m -138.8 150.85 46.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.141 0.972 . . . . 0.0 112.231 169.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.62 137.92 40.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 127.063 2.145 . . . . 0.0 108.389 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.6 tt -127.88 147.16 50.45 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.18 1.392 . . . . 0.0 110.475 -174.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.8 mtt -125.2 130.4 52.05 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 125.047 1.339 . . . . 0.0 109.46 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.08 146.7 50.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.921 1.689 . . . . 0.0 111.426 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -46.85 121.55 3.68 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.802 1.241 . . . . 0.0 111.145 171.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.04 -31.37 51.21 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -170.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.07 -21.24 7.84 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.614 0.626 . . . . 0.0 114.183 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.8 m -108.11 -21.71 12.68 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.902 0.881 . . . . 0.0 112.664 -169.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.29 -3.31 78.16 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.663 1.125 . . . . 0.0 114.951 173.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -69.47 122.11 84.51 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 125.599 1.56 . . . . 0.0 111.281 175.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -55.35 141.95 80.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.027 2.484 . . . . 0.0 113.082 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.07 -39.05 5.4 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.955 0.902 . . . . 0.0 110.267 169.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -149.97 154.69 38.67 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.08 1.352 . . . . 0.0 110.763 -169.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 6.6 m -139.42 145.0 38.35 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.898 1.679 . . . . 0.0 108.339 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.4 mt -123.24 134.79 54.08 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 127.408 2.283 . . . . 0.0 107.632 -175.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 7.7 t -136.02 138.82 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.488 0.715 . . . . 0.0 111.619 -168.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.0 t -114.82 124.98 53.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.221 1.008 . . . . 0.0 111.626 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 74.6 p -74.39 -16.83 60.88 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.171 1.389 . . . . 0.0 114.262 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.78 -1.1 12.13 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 125.504 1.526 . . . . 0.0 113.741 -169.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.6 t -154.93 158.77 39.78 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.093 -1.239 . . . . 0.0 113.054 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -59.92 137.21 90.61 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.127 1.771 . . . . 0.0 114.83 -178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -96.59 176.78 9.35 Favored 'Cis proline' 0 CA--C 1.548 1.191 0 CA-C-N 120.04 1.05 . . . . 0.0 111.026 -11.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.56 163.66 20.72 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.127 -0.983 . . . . 0.0 111.069 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -117.62 134.21 55.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.626 1.57 . . . . 0.0 111.23 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -89.49 146.08 24.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 111.855 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 t -150.36 147.99 28.26 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.151 1.38 . . . . 0.0 111.018 169.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.1 mp -74.76 128.81 36.46 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.557 -0.714 . . . . 0.0 109.116 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.02 63.42 0.26 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.281 1.832 . . . . 0.0 115.841 175.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.05 2.29 1.02 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.895 2.478 . . . . 0.0 116.74 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -54.11 -27.15 31.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -169.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.99 5.49 12.86 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.568 1.547 . . . . 0.0 112.582 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -71.51 -47.72 12.76 Favored Pre-proline 0 N--CA 1.476 0.835 0 CA-C-O 116.568 -1.682 . . . . 0.0 114.761 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 C--O 1.25 1.124 0 C-N-CA 122.546 2.164 . . . . 0.0 113.11 -179.158 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.99 -40.64 87.43 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.66 -45.88 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.225 0.61 . . . . 0.0 109.774 173.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.3 -46.55 88.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.545 0.738 . . . . 0.0 112.565 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -58.39 -51.49 69.58 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.615 0.766 . . . . 0.0 112.331 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.9 m -57.86 -47.6 82.26 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.362 0.665 . . . . 0.0 111.319 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -70.5 -29.27 65.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.854 1.261 . . . . 0.0 113.912 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.7 -49.28 71.5 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 120.576 1.535 . . . . 0.0 110.461 171.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -62.48 -40.54 97.01 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.768 1.227 . . . . 0.0 111.936 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -63.23 -47.83 80.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.598 1.159 . . . . 0.0 112.298 172.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.2 m -57.7 -40.66 80.03 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.067 0.947 . . . . 0.0 111.204 175.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.36 78.41 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.09 -44.63 96.25 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.566 -0.709 . . . . 0.0 111.665 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -68.28 -39.33 82.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.632 0.773 . . . . 0.0 112.42 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.04 -45.24 91.25 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.69 0.677 . . . . 0.0 111.83 169.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -60.81 -42.99 98.73 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.858 0.754 . . . . 0.0 110.73 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.94 -40.18 94.65 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.957 -1.089 . . . . 0.0 113.538 172.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.96 -31.13 71.86 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.27 1.028 . . . . 0.0 113.092 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.7 tp -73.33 -35.72 66.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.279 1.432 . . . . 0.0 111.427 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -62.11 -45.2 94.54 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.082 -1.011 . . . . 0.0 110.88 169.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 tp -51.9 -46.35 64.55 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.441 1.496 . . . . 0.0 111.075 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.82 97.73 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.26 -44.2 99.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.687 0.795 . . . . 0.0 110.598 175.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.56 -49.88 76.07 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.265 0.626 . . . . 0.0 111.562 174.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.0 mmt85 -59.28 -34.81 72.72 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.036 -1.04 . . . . 0.0 112.414 175.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.52 66.96 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.132 0.878 . . . . 0.0 111.765 178.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -25.04 63.11 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.633 -0.667 . . . . 0.0 112.523 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.7 mt -81.93 -43.08 18.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.682 1.193 . . . . 0.0 112.381 175.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.5 p -84.24 -17.5 39.58 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -173.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.87 11.68 83.48 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 175.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.89 172.56 6.18 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.185 1.394 . . . . 0.0 110.147 171.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.13 159.64 14.76 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.455 2.103 . . . . 0.0 114.907 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.6 t -130.52 156.49 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 127.249 2.219 . . . . 0.0 107.53 171.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.99 169.78 35.3 Favored Glycine 0 N--CA 1.468 0.814 0 CA-C-N 120.323 1.42 . . . . 0.0 116.256 -171.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.43 128.85 66.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 125.178 1.391 . . . . 0.0 108.829 -173.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -107.64 59.95 0.62 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 129.178 2.991 . . . . 0.0 110.635 -168.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -53.84 141.13 28.19 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.3 1.04 . . . . 0.0 112.056 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.5 t -139.42 179.52 6.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.067 1.747 . . . . 0.0 111.769 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -66.64 -16.93 64.55 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -169.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.0 p -142.81 -5.02 0.92 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.76 -175.36 5.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.065 1.746 . . . . 0.0 110.599 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -146.07 164.82 30.92 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.697 1.599 . . . . 0.0 109.851 173.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.6 ttp-105 -148.45 154.97 40.6 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.104 1.762 . . . . 0.0 109.814 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.3 mt -114.82 141.18 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.576 1.151 . . . . 0.0 109.272 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 85.3 mtp -132.6 148.33 52.36 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 -174.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.8 158.28 37.43 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.777 2.431 . . . . 0.0 108.86 -168.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.51 153.09 79.01 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 122.104 1.869 . . . . 0.0 112.034 169.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.3 4.72 0.98 Allowed Glycine 0 CA--C 1.537 1.406 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -137.59 -23.71 1.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.6 t -158.21 139.09 9.39 Favored Pre-proline 0 N--CA 1.477 0.911 0 CA-C-N 119.44 1.018 . . . . 0.0 112.829 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.63 -12.78 3.56 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.299 3.333 . . . . 0.0 112.187 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.7 t -82.96 -22.38 33.77 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.056 1.342 . . . . 0.0 113.479 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.78 162.06 37.69 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.349 1.46 . . . . 0.0 111.721 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -52.4 123.34 10.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.472 1.509 . . . . 0.0 112.429 177.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -153.23 160.18 42.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.518 1.527 . . . . 0.0 111.86 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -145.28 146.24 31.57 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.693 1.197 . . . . 0.0 113.6 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.1 t -158.01 153.65 22.66 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.993 2.917 . . . . 0.0 107.724 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -69.52 134.64 28.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.236 1.958 . . . . 0.0 111.064 173.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.456 ' O ' HD23 ' A' ' 64' ' ' LEU . 2.4 tt -68.68 -26.28 65.22 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 123.328 1.537 . . . . 0.0 109.787 173.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -49.52 -14.31 0.11 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 127.968 2.507 . . . . 0.0 113.746 169.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -53.54 -32.74 51.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.929 1.692 . . . . 0.0 112.753 168.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -135.27 -13.04 2.1 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -176.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -121.58 58.24 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.209 1.403 . . . . 0.0 109.074 169.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.63 -23.43 1.01 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 -169.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -121.16 -4.2 9.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -171.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -129.08 -7.0 4.89 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.9 m -75.55 14.37 0.63 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.251 1.02 . . . . 0.0 113.603 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -155.63 -179.2 7.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.42 1.488 . . . . 0.0 110.988 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -51.93 128.02 22.93 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -168.86 -27.86 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.086 2.154 . . . . 0.0 111.439 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -69.23 -6.25 27.96 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.545 1.938 . . . . 0.0 114.796 -170.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.88 165.44 24.63 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.895 1.678 . . . . 0.0 113.442 -178.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.56 13.22 2.13 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.32 1.448 . . . . 0.0 112.841 171.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -155.09 3.48 0.2 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -168.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -120.19 162.87 18.62 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.292 -1.505 . . . . 0.0 113.482 -169.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 t -135.98 143.3 44.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.043 2.137 . . . . 0.0 108.735 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.9 143.88 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.116 1.366 . . . . 0.0 110.641 -169.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -140.17 134.51 31.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.352 1.461 . . . . 0.0 110.601 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mp -113.41 153.03 29.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.235 1.017 . . . . 0.0 113.15 -174.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -145.45 140.34 15.81 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 126.875 2.07 . . . . 0.0 108.745 -172.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -80.1 -5.95 41.37 Favored 'Cis proline' 0 CA--C 1.546 1.077 0 CA-C-N 120.841 1.336 . . . . 0.0 114.015 -3.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -107.35 155.96 19.43 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.84 1.256 . . . . 0.0 113.305 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.82 135.49 95.46 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -84.16 98.23 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 123.633 2.889 . . . . 0.0 108.797 168.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -148.0 156.38 42.59 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.028 -1.045 . . . . 0.0 112.259 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 41.75 0.28 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.99 1.716 . . . . 0.0 112.093 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 55.5 p -73.2 39.18 0.09 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.622 1.969 . . . . 0.0 115.281 -171.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.6 t30 57.33 19.5 5.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 127.022 2.129 . . . . 0.0 115.015 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -158.04 124.33 2.49 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.626 1.17 . . . . 0.0 110.429 -169.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.89 128.94 30.92 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 121.712 1.608 . . . . 0.0 111.212 172.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -78.34 -39.24 40.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.953 0.901 . . . . 0.0 111.311 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -99.98 136.23 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.896 1.678 . . . . 0.0 108.174 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.5 t -135.54 143.82 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 121.868 0.842 . . . . 0.0 111.108 -172.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -125.49 129.56 72.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 128.384 2.674 . . . . 0.0 107.968 -171.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.4 mt -94.08 162.62 13.8 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.097 0.951 . . . . 0.0 112.061 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.74 -9.41 6.36 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -175.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -121.12 9.74 10.57 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.746 1.619 . . . . 0.0 113.298 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.74 8.69 59.22 Favored Glycine 0 CA--C 1.535 1.304 0 N-CA-C 115.833 1.093 . . . . 0.0 115.833 173.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -74.93 137.8 41.92 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.9 1.35 . . . . 0.0 108.551 169.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.37 146.11 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.909 1.284 . . . . 0.0 109.479 -173.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.2 p -52.24 124.37 30.77 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 124.022 0.929 . . . . 0.0 111.539 170.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.64 112.87 3.59 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.742 2.295 . . . . 0.0 111.096 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.563 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.5 p90 -151.45 -179.27 7.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.35 1.86 . . . . 0.0 111.661 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -138.19 142.48 40.03 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.622 0.769 . . . . 0.0 112.156 169.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.07 102.77 8.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 129.235 3.014 . . . . 0.0 108.833 -170.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -96.62 147.9 23.4 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.544 1.138 . . . . 0.0 110.563 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.4 mtt -129.85 135.48 48.44 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.879 1.672 . . . . 0.0 109.271 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.66 152.71 48.3 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.158 1.383 . . . . 0.0 111.0 -176.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -61.09 127.28 30.78 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 121.814 -0.554 . . . . 0.0 109.806 175.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.97 -20.34 57.11 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -175.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.85 -32.65 0.68 Allowed Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.301 0.953 . . . . 0.0 114.582 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 6.9 m -68.38 -27.47 66.26 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.257 1.528 . . . . 0.0 111.255 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 70.55 35.82 68.06 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.806 0.717 . . . . 0.0 113.195 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -133.34 135.61 25.7 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 125.668 1.587 . . . . 0.0 110.439 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.41 152.33 79.0 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.012 2.475 . . . . 0.0 113.071 -176.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.34 -55.21 1.76 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.214 1.805 . . . . 0.0 111.565 -173.55 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -147.98 156.47 42.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 108.643 -169.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.6 m -147.46 138.56 23.65 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.059 -1.026 . . . . 0.0 110.243 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -109.61 146.21 35.13 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 126.814 2.046 . . . . 0.0 109.729 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 54.0 t -140.38 137.17 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.098 0.959 . . . . 0.0 112.038 -169.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.563 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 38.4 t -115.27 154.26 29.41 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.906 1.682 . . . . 0.0 111.641 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.4 m -130.35 9.52 5.18 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.944 1.298 . . . . 0.0 113.488 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.87 -9.61 10.45 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 114.943 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.9 p -156.53 160.07 39.15 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.637 1.219 . . . . 0.0 113.517 -173.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.0 t-105 -60.23 138.5 91.65 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.297 1.839 . . . . 0.0 115.501 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -97.9 177.22 7.93 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.128 1.081 . . . . 0.0 110.935 -11.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.26 160.26 32.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.855 169.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -100.81 166.04 11.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.065 1.346 . . . . 0.0 109.046 169.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -142.07 153.12 43.94 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.2 t -155.86 167.09 31.53 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.233 1.413 . . . . 0.0 112.254 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.89 135.85 48.25 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 109.971 169.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.98 70.5 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.724 2.41 . . . . 0.0 116.547 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 46.4 ptt85 44.03 31.6 0.54 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 128.798 2.839 . . . . 0.0 118.398 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -55.37 -24.04 27.58 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 174.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.6 p -97.43 -0.89 45.43 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.822 2.049 . . . . 0.0 113.759 176.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -138.54 62.18 28.17 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 126.33 1.852 . . . . 0.0 110.743 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.268 3.312 . . . . 0.0 113.369 178.968 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.8 -13.51 34.29 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.865 1.266 . . . . 0.0 114.084 172.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -131.71 -44.2 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.681 1.992 . . . . 0.0 111.181 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.56 79.58 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.448 1.499 . . . . 0.0 113.331 -177.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -65.55 -44.79 85.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.158 0.89 . . . . 0.0 111.207 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.3 m -62.01 -45.82 91.94 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.282 -0.886 . . . . 0.0 111.593 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -60.04 -38.55 83.1 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.328 -0.844 . . . . 0.0 112.253 175.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.81 -47.27 87.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.493 1.042 . . . . 0.0 112.032 174.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -63.54 -41.4 98.45 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.217 1.007 . . . . 0.0 111.379 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.98 -53.32 51.97 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 122.694 0.398 . . . . 0.0 111.782 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.0 m -55.76 -37.12 68.1 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.964 1.306 . . . . 0.0 111.425 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.14 -47.74 83.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.38 1.072 . . . . 0.0 113.89 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.81 98.13 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.389 -0.819 . . . . 0.0 112.254 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -65.08 -42.59 93.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.485 0.714 . . . . 0.0 110.959 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -60.08 -43.71 95.3 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.199 0.6 . . . . 0.0 112.408 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 34.9 m -59.82 -41.79 92.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 118.597 0.635 . . . . 0.0 111.156 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.39 -40.88 94.02 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.864 -1.148 . . . . 0.0 113.5 172.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.75 -33.51 75.82 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.171 -0.956 . . . . 0.0 113.041 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.49 -35.85 75.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.448 1.099 . . . . 0.0 111.742 173.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.36 -44.22 95.44 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.91 -1.119 . . . . 0.0 111.773 170.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.57 -45.15 62.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.188 1.395 . . . . 0.0 111.471 169.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.09 98.11 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.64 -45.79 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 118.898 0.772 . . . . 0.0 110.713 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.87 -23.95 66.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -103.03 -24.78 13.61 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.33 74.59 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.983 1.265 . . . . 0.0 113.801 176.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.7 t -69.4 -28.28 66.02 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 121.637 -0.664 . . . . 0.0 112.73 173.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.4 mt -85.2 -28.59 25.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.518 1.527 . . . . 0.0 113.219 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -86.44 -15.73 39.34 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -169.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.1 -9.3 33.3 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 124.507 1.051 . . . . 0.0 115.266 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -138.32 150.84 68.03 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 129.447 3.099 . . . . 0.0 105.406 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -40.41 154.97 0.05 OUTLIER 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.099 3.199 . . . . 0.0 115.507 169.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.9 t -104.01 161.84 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.871 1.268 . . . . 0.0 108.311 171.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -154.44 176.28 32.3 Favored Glycine 0 CA--C 1.522 0.521 0 CA-C-O 122.299 0.944 . . . . 0.0 114.991 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 63.2 mt -134.95 118.42 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 124.504 1.122 . . . . 0.0 108.002 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -76.8 152.97 35.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.347 1.459 . . . . 0.0 110.687 170.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -143.02 147.85 35.79 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.391 1.477 . . . . 0.0 113.03 -175.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.7 p -136.58 -176.36 4.32 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.569 1.948 . . . . 0.0 111.302 176.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.63 -25.29 62.55 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 178.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.6 p -143.2 -2.09 1.02 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -173.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.73 179.87 7.15 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.86 1.314 . . . . 0.0 112.988 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.482 ' CZ2' ' HA ' ' A' ' 74' ' ' ASN . 58.6 p-90 -149.15 162.78 39.3 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.303 2.241 . . . . 0.0 108.762 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 41.8 mtm-85 -143.96 132.04 21.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.402 1.081 . . . . 0.0 111.208 172.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.3 mm -69.76 130.82 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 171.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.8 mtm -134.11 147.79 50.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 122.077 0.942 . . . . 0.0 111.719 -176.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.7 164.83 33.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.912 1.285 . . . . 0.0 111.786 -169.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.03 -23.41 75.68 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.755 2.97 . . . . 0.0 114.527 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.86 -53.53 1.69 Allowed Glycine 0 CA--C 1.533 1.201 0 C-N-CA 126.929 2.204 . . . . 0.0 116.556 169.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -142.62 -23.05 0.66 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.294 1.437 . . . . 0.0 114.299 -172.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.3 t -133.32 124.12 18.06 Favored Pre-proline 0 N--CA 1.475 0.805 0 CA-C-N 119.021 0.828 . . . . 0.0 113.021 -174.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -86.55 -0.02 8.04 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.82 3.013 . . . . 0.0 111.929 169.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.7 m -111.74 -5.22 14.46 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.662 1.585 . . . . 0.0 114.262 -169.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -141.79 146.04 35.46 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.064 1.346 . . . . 0.0 110.839 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -51.27 -37.26 46.33 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.95 1.7 . . . . 0.0 115.047 -171.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 9.2 tpt85 -27.32 96.97 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 129.007 2.923 . . . . 0.0 115.241 -171.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.22 154.82 34.97 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.305 1.042 . . . . 0.0 112.124 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.6 m -143.82 151.0 51.97 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 125.886 1.674 . . . . 0.0 110.164 169.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.14 145.87 80.02 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.183 1.922 . . . . 0.0 110.21 169.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 63.6 tp -57.12 -71.84 0.09 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.337 1.055 . . . . 0.0 113.595 -169.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 43.83 1.79 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 130.612 3.565 . . . . 0.0 120.45 169.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -60.42 -21.76 62.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.499 1.919 . . . . 0.0 115.351 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -150.35 -38.94 0.14 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.951 1.701 . . . . 0.0 110.698 170.165 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.78 44.35 0.08 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.112 2.165 . . . . 0.0 113.12 169.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.31 20.44 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 -169.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -133.36 25.96 4.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.084 1.354 . . . . 0.0 112.033 170.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -120.19 -6.89 9.89 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.848 1.659 . . . . 0.0 111.679 173.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.9 m -71.16 -2.12 14.75 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.804 1.642 . . . . 0.0 113.123 169.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -139.5 168.99 18.58 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.571 1.548 . . . . 0.0 113.253 -175.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.482 ' HA ' ' CZ2' ' A' ' 47' ' ' TRP . 59.0 t30 -51.13 119.55 4.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 117.307 2.336 . . . . 0.0 117.307 -169.426 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -141.72 10.19 2.01 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.54 2.336 . . . . 0.0 111.459 169.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -79.52 -17.23 54.5 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.03 1.332 . . . . 0.0 113.529 -176.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.11 167.3 28.15 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -144.08 27.71 1.43 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.802 2.041 . . . . 0.0 110.247 169.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -141.45 -5.81 1.06 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.442 1.497 . . . . 0.0 114.636 -169.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.2 mt -115.3 163.4 15.74 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.865 1.317 . . . . 0.0 113.614 -170.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.2 t -134.38 134.79 42.1 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 128.672 2.789 . . . . 0.0 106.797 169.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.51 144.26 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.421 1.088 . . . . 0.0 110.884 -169.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -137.36 157.4 46.67 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.028 1.731 . . . . 0.0 109.585 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -153.71 168.56 25.84 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.546 -0.721 . . . . 0.0 112.902 172.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -157.65 155.08 26.43 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.525 1.93 . . . . 0.0 110.269 177.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -77.46 -10.75 31.7 Favored 'Cis proline' 0 CA--C 1.543 0.946 0 CA-C-N 120.898 1.357 . . . . 0.0 114.864 2.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -66.1 -178.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.303 1.441 . . . . 0.0 111.586 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.73 141.11 29.63 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -176.024 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.39 131.44 24.8 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.825 2.35 . . . . 0.0 110.407 175.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -160.38 -154.52 0.38 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.587 0.755 . . . . 0.0 111.523 -169.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -135.71 26.81 3.36 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.954 2.502 . . . . 0.0 110.148 169.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.2 m -60.37 156.87 14.9 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.124 2.17 . . . . 0.0 115.086 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -71.96 20.05 0.06 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 126.031 1.732 . . . . 0.0 114.84 175.546 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -150.36 161.29 31.11 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.379 1.872 . . . . 0.0 109.823 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.99 172.07 16.24 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 122.902 2.402 . . . . 0.0 112.964 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -108.64 -10.58 15.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.87 1.668 . . . . 0.0 111.958 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.56 139.33 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.238 1.415 . . . . 0.0 108.811 169.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.443 ' H ' HG22 ' A' ' 106' ' ' THR . 58.8 t -134.31 139.3 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 109.577 -175.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.92 119.16 48.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 126.635 1.974 . . . . 0.0 109.5 -169.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.64 152.27 40.55 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.373 1.469 . . . . 0.0 111.187 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.01 -28.64 58.15 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.895 1.278 . . . . 0.0 114.127 172.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.94 -11.31 59.59 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.628 1.571 . . . . 0.0 113.58 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.25 4.77 59.62 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 124.648 1.118 . . . . 0.0 114.887 -177.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -72.24 150.99 43.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.491 1.145 . . . . 0.0 108.408 169.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -128.82 137.55 56.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 124.774 1.23 . . . . 0.0 108.427 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.443 HG22 ' H ' ' A' ' 98' ' ' VAL . 6.3 t -56.26 133.34 75.61 Favored Pre-proline 0 CA--C 1.544 0.75 0 CA-C-O 118.522 -0.752 . . . . 0.0 111.255 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -59.94 117.53 4.29 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.562 2.175 . . . . 0.0 112.82 174.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 5.6 p90 -155.13 175.6 13.63 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.448 1.499 . . . . 0.0 111.356 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 p -142.14 153.2 43.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.499 1.12 . . . . 0.0 110.508 169.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.12 134.67 33.18 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.884 2.073 . . . . 0.0 109.142 -169.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -125.71 143.17 51.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.461 1.504 . . . . 0.0 110.383 -175.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.4 mtt -122.07 128.98 51.98 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.556 1.542 . . . . 0.0 109.667 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.11 146.16 50.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.64 1.576 . . . . 0.0 111.573 -175.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -54.18 124.98 17.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.48 1.112 . . . . 0.0 109.927 171.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.55 -14.07 17.76 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 -174.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -103.9 -50.05 1.04 Allowed Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.917 1.246 . . . . 0.0 113.417 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.4 p -79.45 -27.77 41.62 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.442 1.121 . . . . 0.0 113.558 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.97 8.27 73.05 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.987 0.803 . . . . 0.0 113.01 -169.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.38 134.66 58.22 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 124.901 1.28 . . . . 0.0 110.836 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.57 144.13 65.38 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.787 2.325 . . . . 0.0 112.663 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.24 -40.38 4.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.922 0.889 . . . . 0.0 110.125 169.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.45 154.81 38.36 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.327 1.051 . . . . 0.0 111.383 -169.028 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.9 m -145.75 145.78 30.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.966 1.307 . . . . 0.0 109.986 177.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.5 mp -120.17 144.55 47.63 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.122 2.569 . . . . 0.0 109.365 -179.155 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 15.9 t -142.23 138.07 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.253 1.021 . . . . 0.0 111.581 -170.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 10.6 t -116.7 152.89 33.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.432 1.093 . . . . 0.0 112.234 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 39.6 m -130.5 5.86 4.77 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.312 1.445 . . . . 0.0 113.19 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.85 -15.25 5.43 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 115.915 1.126 . . . . 0.0 115.915 172.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.2 t -151.64 159.04 44.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.76 1.78 . . . . 0.0 113.798 -172.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 -57.5 135.28 82.02 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 126.465 1.906 . . . . 0.0 115.524 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -96.28 175.98 10.34 Favored 'Cis proline' 0 CA--C 1.547 1.146 0 CA-C-N 120.139 1.086 . . . . 0.0 110.603 -11.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.43 161.75 22.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.245 1.022 . . . . 0.0 112.085 169.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -90.12 154.79 19.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.208 1.403 . . . . 0.0 107.788 169.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -139.44 152.54 47.12 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.3 t -155.18 151.35 28.09 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.692 1.197 . . . . 0.0 112.031 -169.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.98 131.92 45.85 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 169.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.57 66.08 0.12 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.628 1.971 . . . . 0.0 115.267 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 52.05 13.77 0.29 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 118.58 2.808 . . . . 0.0 118.58 178.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -57.51 -32.17 66.76 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -169.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 68.3 p -79.77 -18.21 51.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 68.4 ttt-85 -66.73 -47.03 56.54 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-O 116.54 -1.695 . . . . 0.0 115.263 -171.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo . . . . . 0 C--O 1.249 1.071 0 C-N-CA 122.729 2.286 . . . . 0.0 113.223 -178.428 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 . . . . . 0 N--CA 1.473 0.684 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -66.57 -42.07 87.62 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.24 -40.05 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.716 -0.659 . . . . 0.0 109.987 175.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.3 95.95 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.311 0.959 . . . . 0.0 112.659 173.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.19 -42.43 96.65 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.049 -1.032 . . . . 0.0 111.575 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.0 m -61.16 -50.37 73.42 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.745 0.818 . . . . 0.0 111.711 173.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -57.46 -40.4 78.44 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.914 1.686 . . . . 0.0 112.408 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.98 72.01 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.989 0.813 . . . . 0.0 111.376 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -61.73 -41.69 97.99 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.129 0.972 . . . . 0.0 111.876 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.47 -50.01 71.38 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.767 1.227 . . . . 0.0 112.538 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 61.8 m -65.28 -30.26 71.11 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.237 -0.915 . . . . 0.0 112.113 174.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.9 87.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.679 1.127 . . . . 0.0 113.496 172.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.85 -43.76 98.2 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.35 -0.844 . . . . 0.0 111.372 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -64.76 -39.2 93.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.525 0.73 . . . . 0.0 112.664 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -61.31 -42.5 98.77 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 111.774 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.8 m -59.32 -43.86 92.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.424 0.556 . . . . 0.0 110.727 175.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -41.87 96.5 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.981 -1.075 . . . . 0.0 113.474 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.86 -32.71 74.32 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.997 0.919 . . . . 0.0 113.128 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.9 tp -73.04 -33.87 65.96 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.06 1.344 . . . . 0.0 111.683 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.41 -44.23 95.26 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.948 -1.095 . . . . 0.0 110.877 169.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.7 -45.33 66.82 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.34 1.456 . . . . 0.0 111.288 169.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.61 98.03 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.92 -47.29 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.088 0.858 . . . . 0.0 110.684 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -60.34 -35.44 75.65 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.708 0.803 . . . . 0.0 112.796 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -76.29 -36.63 58.26 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.389 0.676 . . . . 0.0 112.626 174.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.92 -36.06 82.72 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.833 1.197 . . . . 0.0 112.96 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -73.32 -27.32 61.46 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.9 -25.34 23.3 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.9 m -89.28 -22.07 22.88 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -169.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.75 5.85 89.27 Favored Glycine 0 CA--C 1.542 1.734 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -143.44 150.81 52.67 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 127.653 2.381 . . . . 0.0 107.302 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -46.24 163.25 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.761 2.974 . . . . 0.0 114.593 169.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -123.37 160.72 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.616 1.566 . . . . 0.0 108.459 176.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.63 173.75 34.37 Favored Glycine 0 CA--C 1.521 0.458 0 N-CA-C 116.111 1.204 . . . . 0.0 116.111 -177.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.2 mt -132.63 123.66 49.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.832 1.253 . . . . 0.0 108.998 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -83.48 145.76 28.76 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.597 1.959 . . . . 0.0 110.758 170.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -141.55 145.2 34.82 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.311 1.445 . . . . 0.0 111.801 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.2 p -146.83 176.12 10.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.996 1.318 . . . . 0.0 112.056 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -61.09 -10.11 5.66 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.445 1.098 . . . . 0.0 113.86 170.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.9 m -130.7 -15.8 3.44 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.92 168.73 24.82 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 123.178 1.466 . . . . 0.0 114.079 -178.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -135.74 144.33 45.8 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.904 2.882 . . . . 0.0 105.478 169.231 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -160.01 129.62 5.26 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.674 0.79 . . . . 0.0 111.508 -172.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mt -92.57 139.36 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.2 mtp -136.66 145.27 44.59 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.038 0.935 . . . . 0.0 112.189 -169.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 m -138.46 160.79 62.22 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 126.574 1.95 . . . . 0.0 112.137 -169.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -81.17 12.04 2.82 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.048 3.165 . . . . 0.0 115.406 -171.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -39.66 -40.17 1.44 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 127.005 2.24 . . . . 0.0 118.687 -169.34 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -69.1 -44.5 72.35 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.219 1.51 . . . . 0.0 112.895 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -167.92 129.87 1.24 Allowed Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 123.935 0.894 . . . . 0.0 112.83 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.2 -24.6 6.55 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.029 2.486 . . . . 0.0 111.725 169.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.4 m -75.18 -24.86 57.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.542 1.537 . . . . 0.0 113.517 -175.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.48 21.06 4.73 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.339 1.455 . . . . 0.0 112.674 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . 0.27 0.0 OUTLIER 54.08 -13.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 131.567 3.947 . . . . 0.0 120.288 173.475 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -38.74 110.01 0.12 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 128.062 2.545 . . . . 0.0 114.198 -170.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.87 153.92 40.64 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.172 1.389 . . . . 0.0 113.92 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 t -136.49 140.59 32.84 Favored Pre-proline 0 N--CA 1.469 0.495 0 C-N-CA 126.891 2.076 . . . . 0.0 108.194 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -63.53 151.71 83.69 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 CA-C-N 121.156 1.449 . . . . 0.0 109.716 169.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 15.8 tp -65.65 12.7 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -176.275 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -61.38 -13.53 20.64 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.022 -1.674 . . . . 0.0 114.077 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.58 -15.09 24.3 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.358 1.063 . . . . 0.0 113.424 169.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -141.58 -44.59 0.36 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.091 1.356 . . . . 0.0 112.389 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.56 47.69 1.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.212 1.805 . . . . 0.0 111.697 173.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.7 -35.15 1.71 Allowed 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 -169.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -129.08 15.25 6.26 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.212 1.405 . . . . 0.0 112.578 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -143.46 6.05 1.45 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -174.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 82.6 p -58.18 -20.13 38.69 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -157.95 168.89 25.87 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.49 1.516 . . . . 0.0 113.48 -169.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.81 -41.1 0.07 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.84 3.256 . . . . 0.0 118.008 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -73.19 70.42 1.12 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.309 1.844 . . . . 0.0 111.331 176.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -129.15 -28.71 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -168.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.58 176.65 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.413 1.006 . . . . 0.0 113.642 -176.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -125.93 -25.04 3.67 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.579 1.952 . . . . 0.0 113.477 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -139.17 14.53 2.62 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.383 1.073 . . . . 0.0 113.599 -169.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -124.16 156.19 37.14 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -168.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.3 m -133.01 134.3 44.25 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.565 2.746 . . . . 0.0 107.806 169.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -113.37 141.51 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.366 1.066 . . . . 0.0 110.55 -169.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -140.1 85.56 2.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.554 1.542 . . . . 0.0 110.426 -170.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.3 157.22 37.43 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.928 -1.107 . . . . 0.0 112.486 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.82 145.34 27.45 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.852 1.661 . . . . 0.0 109.365 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.56 -14.29 24.46 Favored 'Cis proline' 0 CA--C 1.543 0.975 0 CA-C-N 120.076 1.063 . . . . 0.0 113.825 -4.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -60.62 119.95 9.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.142 1.377 . . . . 0.0 112.328 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.43 145.83 85.89 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.262 1.025 . . . . 0.0 113.505 -177.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.92 63.96 8.73 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 124.311 3.341 . . . . 0.0 112.386 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -147.67 159.13 44.12 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.158 1.383 . . . . 0.0 111.735 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -74.34 89.63 2.1 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.655 1.217 . . . . 0.0 113.594 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 p -61.02 -3.41 0.79 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 128.043 2.537 . . . . 0.0 116.224 171.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 2.6 p30 54.31 6.9 0.12 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.476 2.31 . . . . 0.0 115.82 -169.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -140.84 165.37 30.04 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 128.66 2.784 . . . . 0.0 108.23 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.2 155.09 65.26 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-N 120.094 1.069 . . . . 0.0 112.155 169.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -102.37 -44.55 5.36 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.595 1.158 . . . . 0.0 110.72 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.79 135.72 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.47 ' H ' HG22 ' A' ' 106' ' ' THR . 89.7 t -136.04 139.12 46.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.684 1.194 . . . . 0.0 109.745 -177.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.5 119.43 50.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 127.578 2.351 . . . . 0.0 108.206 -170.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -83.23 159.55 21.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.768 0.794 . . . . 0.0 111.355 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.25 -26.12 50.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.074 1.349 . . . . 0.0 114.449 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -76.01 -16.67 59.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.805 1.642 . . . . 0.0 113.595 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.05 7.14 64.41 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.331 0.967 . . . . 0.0 114.498 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -84.66 143.23 29.35 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 169.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.4 mm -125.75 149.77 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.14 1.376 . . . . 0.0 109.966 -168.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.47 HG22 ' H ' ' A' ' 98' ' ' VAL . 11.8 t -56.34 134.07 76.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 O-C-N 121.655 -0.653 . . . . 0.0 110.925 169.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -75.65 117.35 4.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.51 2.14 . . . . 0.0 111.216 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.518 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 10.1 p90 -149.05 179.09 8.14 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 127.055 2.142 . . . . 0.0 111.021 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -138.59 155.54 48.25 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 111.246 169.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.4 tp -136.97 103.72 5.24 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.875 2.07 . . . . 0.0 108.985 -169.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -95.19 147.09 23.83 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.364 0.665 . . . . 0.0 110.446 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 59.0 mtt -126.7 125.66 42.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.741 1.616 . . . . 0.0 110.392 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.79 140.1 52.25 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.205 1.402 . . . . 0.0 111.55 -176.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -64.52 119.38 10.34 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.142 0.977 . . . . 0.0 110.565 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.43 -22.03 52.93 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 178.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -84.38 -19.57 60.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.724 1.154 . . . . 0.0 115.269 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.2 p -135.18 -24.56 1.42 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.276 1.538 . . . . 0.0 114.445 -170.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 84.6 -1.78 88.56 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.975 1.274 . . . . 0.0 114.105 -172.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -79.45 138.97 55.18 Favored Pre-proline 0 CA--C 1.545 0.773 0 CA-C-N 118.682 1.241 . . . . 0.0 112.22 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.14 146.42 57.81 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.779 2.319 . . . . 0.0 111.642 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.94 -42.06 2.85 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.976 0.91 . . . . 0.0 111.265 174.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -148.86 159.73 43.9 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.589 1.156 . . . . 0.0 111.245 -168.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.8 m -148.2 139.99 23.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.728 1.211 . . . . 0.0 109.521 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.9 mp -109.55 144.82 37.32 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.524 1.93 . . . . 0.0 109.374 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 35.1 t -138.48 136.14 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.654 1.182 . . . . 0.0 111.366 -169.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.518 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 20.1 t -115.98 154.87 29.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.108 1.363 . . . . 0.0 111.843 178.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 m -131.98 9.95 4.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.187 1.395 . . . . 0.0 113.267 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 115.89 -6.75 19.81 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.85 1.214 . . . . 0.0 115.217 176.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 73.4 m -149.05 150.66 33.15 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.649 1.224 . . . . 0.0 113.33 -169.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -58.45 137.0 85.66 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 124.909 1.284 . . . . 0.0 114.41 173.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.17 174.66 11.54 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 CA-C-N 120.147 1.088 . . . . 0.0 111.032 -11.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.28 166.01 15.13 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.076 0.941 . . . . 0.0 110.937 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -110.54 165.05 12.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.999 1.32 . . . . 0.0 109.132 171.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -141.98 155.66 45.45 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.4 t -151.87 151.08 30.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.678 1.591 . . . . 0.0 111.005 -173.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.73 133.04 47.82 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 67.91 0.07 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.871 2.068 . . . . 0.0 115.431 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 0.0 OUTLIER 50.05 16.47 0.24 Allowed 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.28 -34.32 70.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.5 p -88.26 -12.31 44.02 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 174.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -61.8 134.91 94.2 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.011 0.925 . . . . 0.0 112.523 -169.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo . . . . . 0 C--O 1.25 1.088 0 C-N-CA 123.691 2.927 . . . . 0.0 113.264 168.878 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.914 0.388 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.46 -11.59 16.94 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.801 2.04 . . . . 0.0 115.156 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.07 -44.44 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 125.652 1.581 . . . . 0.0 110.088 173.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.23 -38.42 86.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -56.23 -50.02 72.48 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.275 0.943 . . . . 0.0 112.65 172.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.6 m -64.77 -49.59 70.16 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.564 0.746 . . . . 0.0 111.131 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -72.16 -26.82 62.24 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -172.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.06 -53.32 58.62 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.44 1.018 . . . . 0.0 110.767 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -66.47 -36.56 83.07 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.286 0.634 . . . . 0.0 112.502 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -59.69 -48.6 81.02 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.17 169.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.3 m -58.93 -41.51 87.52 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.538 0.735 . . . . 0.0 111.179 176.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.62 -40.4 88.76 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 175.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.7 96.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.339 -0.851 . . . . 0.0 111.533 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.34 -44.56 96.2 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.829 0.852 . . . . 0.0 111.704 174.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -59.81 -44.34 94.06 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 172.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 48.3 m -61.16 -44.04 97.94 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.819 0.736 . . . . 0.0 110.8 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.76 95.36 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.053 -1.029 . . . . 0.0 113.165 172.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.18 -33.94 77.2 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.016 0.926 . . . . 0.0 113.143 175.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -71.7 -33.16 68.55 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.654 1.182 . . . . 0.0 112.143 171.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -63.93 -43.74 94.96 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.888 -1.132 . . . . 0.0 111.14 169.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.33 -45.54 69.11 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.77 1.628 . . . . 0.0 111.255 169.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.32 -47.04 86.01 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.478 0.711 . . . . 0.0 112.394 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -59.11 -41.23 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.787 -1.196 . . . . 0.0 111.401 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.04 -42.32 97.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.439 0.696 . . . . 0.0 112.768 172.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -63.44 -35.08 79.24 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.603 1.161 . . . . 0.0 112.943 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.0 95.07 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -174.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.3 t -76.85 -23.08 52.71 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 98.6 mt -89.61 -36.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.64 1.176 . . . . 0.0 113.172 -176.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.0 p -84.34 -16.58 42.41 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.47 -0.01 76.95 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -142.59 149.25 49.92 Favored Pre-proline 0 N--CA 1.471 0.582 0 C-N-CA 126.438 1.895 . . . . 0.0 108.576 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -47.66 144.81 10.25 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.214 1.942 . . . . 0.0 111.077 168.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.5 m -109.39 175.12 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.773 0.829 . . . . 0.0 111.15 -178.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.38 165.69 30.95 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 115.408 0.923 . . . . 0.0 115.408 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.47 116.07 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 124.915 1.286 . . . . 0.0 107.955 177.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 34.5 t-80 -80.52 147.14 30.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 126.775 2.03 . . . . 0.0 111.243 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.9 142.18 30.65 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.706 1.602 . . . . 0.0 111.622 -179.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 24.1 p -132.94 177.0 7.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.782 1.633 . . . . 0.0 111.553 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -57.99 -14.72 7.0 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 170.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.9 m -137.06 -10.72 1.74 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -169.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.34 174.4 15.49 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.932 1.242 . . . . 0.0 112.602 179.049 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 12.4 p90 -142.07 156.06 45.39 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.409 1.484 . . . . 0.0 110.018 169.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -150.91 151.93 32.89 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.167 1.387 . . . . 0.0 110.64 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 6.0 mt -109.15 141.84 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.977 0.808 . . . . 0.0 109.606 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.1 mtp -134.74 149.98 50.51 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.421 1.088 . . . . 0.0 111.407 -175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.4 m -142.48 169.19 11.38 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 127.073 2.149 . . . . 0.0 111.372 -169.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -55.94 -36.37 95.65 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.476 2.784 . . . . 0.0 114.862 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 66.14 -42.38 0.16 Allowed Glycine 0 CA--C 1.541 1.659 0 C-N-CA 127.147 2.308 . . . . 0.0 117.037 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -143.84 -31.25 0.47 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -172.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.4 p -134.0 57.06 22.06 Favored Pre-proline 0 N--CA 1.485 1.289 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -169.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.24 -20.51 70.29 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 122.871 2.381 . . . . 0.0 114.547 -177.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -64.11 -8.94 13.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.322 1.449 . . . . 0.0 114.453 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -135.98 -128.53 0.15 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.262 1.825 . . . . 0.0 110.595 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -139.53 118.42 12.48 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.685 1.594 . . . . 0.0 109.894 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -152.53 159.5 43.29 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.36 1.464 . . . . 0.0 110.654 176.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 40.8 m95 -136.4 130.32 32.55 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.695 1.198 . . . . 0.0 112.239 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.2 t -142.38 138.0 16.08 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 126.748 2.019 . . . . 0.0 108.051 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -50.77 131.6 34.3 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.223 2.615 . . . . 0.0 112.81 170.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 29.4 tp -68.28 108.14 3.08 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.033 0.933 . . . . 0.0 111.02 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -138.61 -13.15 1.3 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -54.48 -29.04 48.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.604 1.562 . . . . 0.0 114.382 -172.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -142.28 27.06 1.77 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.178 1.791 . . . . 0.0 111.769 169.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -143.42 39.04 1.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.692 2.397 . . . . 0.0 109.541 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.13 -24.03 2.51 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 117.033 2.235 . . . . 0.0 117.033 -168.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -132.34 20.51 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.635 1.574 . . . . 0.0 112.031 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -132.39 4.3 3.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.384 1.474 . . . . 0.0 113.29 -170.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -34.86 41.15 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.157 1.783 . . . . 0.0 114.705 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -130.86 151.08 51.68 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.533 1.933 . . . . 0.0 111.277 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.09 158.64 43.88 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.078 1.351 . . . . 0.0 112.493 -169.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -158.18 58.68 0.46 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.89 2.076 . . . . 0.0 109.006 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 9.7 m0 -59.91 -24.34 64.23 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 117.02 2.23 . . . . 0.0 117.02 -169.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 166.06 20.16 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.731 1.15 . . . . 0.0 113.791 -177.219 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -137.4 15.14 2.98 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.45 1.1 . . . . 0.0 112.638 169.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.51 7.6 0.25 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.879 1.271 . . . . 0.0 113.817 -171.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.76 169.44 13.85 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.479 1.511 . . . . 0.0 112.03 -172.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -138.61 140.92 39.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.565 1.946 . . . . 0.0 109.024 169.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.8 143.97 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 125.339 1.456 . . . . 0.0 110.258 -173.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -137.52 152.82 49.89 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.614 1.966 . . . . 0.0 109.728 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.5 tt -151.16 146.23 25.97 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.868 0.867 . . . . 0.0 111.98 -170.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.3 pp0? -149.14 156.71 40.18 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 125.408 1.483 . . . . 0.0 110.517 169.525 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -77.2 -16.13 25.61 Favored 'Cis proline' 0 CA--C 1.541 0.843 0 CA-C-N 120.355 1.163 . . . . 0.0 114.128 -0.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -70.08 151.57 45.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.57 1.148 . . . . 0.0 113.418 -175.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -63.45 119.3 52.26 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.896 1.678 . . . . 0.0 112.582 178.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -80.29 64.85 8.92 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.137 3.225 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -145.92 157.3 43.9 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.262 1.425 . . . . 0.0 111.587 -174.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -66.7 75.46 0.11 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.826 1.65 . . . . 0.0 113.872 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.9 t -75.85 159.15 31.28 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.653 1.981 . . . . 0.0 113.146 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.16 -8.59 55.55 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.317 1.447 . . . . 0.0 113.085 169.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -134.41 163.97 47.33 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 125.825 1.65 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.34 145.16 37.97 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 121.549 1.5 . . . . 0.0 110.466 168.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -73.91 -53.24 10.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.227 1.011 . . . . 0.0 111.017 173.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.0 t -81.92 140.31 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.667 1.187 . . . . 0.0 109.496 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 53.7 t -130.91 142.9 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.959 0.903 . . . . 0.0 111.07 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.99 127.42 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 127.784 2.433 . . . . 0.0 108.736 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.3 mt -89.12 156.9 18.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.394 0.616 . . . . 0.0 111.307 170.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.2 -21.77 60.0 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -71.16 -20.27 62.32 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.976 1.71 . . . . 0.0 113.575 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.62 3.3 62.75 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.897 1.237 . . . . 0.0 114.775 -177.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.02 147.09 28.37 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 118.455 1.127 . . . . 0.0 108.663 169.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.1 mm -131.42 155.89 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 124.935 1.294 . . . . 0.0 110.241 -168.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.7 p -55.67 129.6 70.74 Favored Pre-proline 0 N--CA 1.471 0.587 0 O-C-N 121.273 -0.892 . . . . 0.0 110.224 169.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -71.89 119.88 6.49 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.186 1.924 . . . . 0.0 111.456 175.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.479 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 13.1 p90 -149.84 174.74 12.32 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.229 1.811 . . . . 0.0 111.337 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 94.7 p -137.53 151.62 48.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.683 0.754 . . . . 0.0 111.118 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -139.76 128.32 22.99 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.281 1.832 . . . . 0.0 108.48 -169.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -123.24 150.96 42.78 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.611 1.565 . . . . 0.0 110.275 -173.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.5 mtt -129.67 142.13 50.78 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.873 1.269 . . . . 0.0 109.614 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.5 143.65 41.8 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.02 1.328 . . . . 0.0 111.046 -177.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.19 122.09 15.28 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.683 0.674 . . . . 0.0 110.133 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.07 -23.32 65.38 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -176.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -97.5 -48.67 1.95 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.766 1.174 . . . . 0.0 113.037 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.3 m -66.87 -31.28 71.78 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 117.951 0.875 . . . . 0.0 112.046 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.68 30.63 61.59 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 123.998 0.809 . . . . 0.0 113.665 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -133.36 149.35 72.17 Favored Pre-proline 0 N--CA 1.474 0.729 0 C-N-CA 125.873 1.669 . . . . 0.0 111.218 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.17 152.03 83.57 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.173 2.582 . . . . 0.0 112.2 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.76 -45.87 1.17 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 126.082 1.753 . . . . 0.0 112.36 -169.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.4 tp -151.66 154.74 36.97 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.33 1.452 . . . . 0.0 109.275 -173.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -146.38 144.79 29.98 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 123.856 0.862 . . . . 0.0 109.628 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.5 mt -126.0 136.38 52.92 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.561 2.345 . . . . 0.0 108.168 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.99 126.93 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.399 1.08 . . . . 0.0 110.708 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.479 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 43.4 t -93.82 -44.31 8.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -172.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 20.4 m 54.18 -5.54 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 -173.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.65 -1.5 3.97 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.342 1.448 . . . . 0.0 116.001 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 6.2 t -156.67 156.18 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.858 1.829 . . . . 0.0 114.88 -172.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.5 t-105 -61.18 137.53 94.27 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 125.812 1.645 . . . . 0.0 114.937 175.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -94.69 174.58 13.72 Favored 'Cis proline' 0 CA--C 1.546 1.09 0 CA-C-N 120.048 1.053 . . . . 0.0 110.487 -11.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.29 145.72 55.42 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.625 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -96.9 127.56 42.99 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.092 1.757 . . . . 0.0 110.555 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -96.17 143.66 27.08 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.526 1.53 . . . . 0.0 112.252 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.1 t -147.35 151.96 37.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.582 1.553 . . . . 0.0 111.334 170.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.57 132.62 44.92 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.48 64.34 0.11 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.939 2.096 . . . . 0.0 115.732 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 0.0 OUTLIER 48.58 15.44 0.09 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 128.655 2.782 . . . . 0.0 117.891 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.25 -39.49 79.29 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.4 m -86.53 -15.05 41.21 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.51 1.124 . . . . 0.0 112.836 178.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 48.9 ttt-85 -66.98 138.02 94.91 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 120.991 -1.068 . . . . 0.0 112.237 -171.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 123.629 2.886 . . . . 0.0 113.137 168.648 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.65 -36.15 78.21 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.311 -0.868 . . . . 0.0 112.6 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.3 t -73.55 -36.14 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.543 1.137 . . . . 0.0 110.584 173.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.86 70.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.605 1.162 . . . . 0.0 112.701 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.412 ' HA ' HD12 ' A' ' 121' ' ' LEU . 24.7 t-20 -57.83 -56.53 20.73 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.418 1.008 . . . . 0.0 112.418 169.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.4 m -58.9 -46.24 88.36 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.604 0.761 . . . . 0.0 111.297 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -65.96 -36.11 82.44 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 117.516 -1.231 . . . . 0.0 113.249 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.28 70.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.889 1.677 . . . . 0.0 110.978 171.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -61.89 -40.8 96.68 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.734 1.214 . . . . 0.0 111.973 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.7 tp10 -64.37 -50.19 68.65 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.265 1.426 . . . . 0.0 112.465 173.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 92.2 m -58.5 -37.17 75.02 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.173 1.389 . . . . 0.0 111.032 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.41 -44.93 70.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.666 1.187 . . . . 0.0 114.142 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.367 -0.833 . . . . 0.0 111.571 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -67.39 -39.42 85.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.736 0.815 . . . . 0.0 112.315 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.33 -39.85 92.06 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.094 0.861 . . . . 0.0 112.068 171.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.6 m -58.83 -42.09 88.44 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.57 -0.707 . . . . 0.0 110.827 174.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.21 -36.92 85.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.793 -1.192 . . . . 0.0 113.973 171.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.71 -32.91 73.88 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 120.774 -1.204 . . . . 0.0 113.321 174.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.9 tp -70.07 -34.73 73.56 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.192 -0.942 . . . . 0.0 111.637 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -62.6 -45.22 93.87 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.162 -0.961 . . . . 0.0 111.579 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.1 tp -53.98 -48.22 70.58 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.522 1.129 . . . . 0.0 111.542 170.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.14 -42.17 80.48 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 176.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.11 -45.19 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.195 -0.941 . . . . 0.0 111.123 172.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.42 -6.83 7.98 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.578 1.551 . . . . 0.0 113.884 174.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 57.4 mmt-85 -109.54 -31.36 7.53 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.932 1.293 . . . . 0.0 112.139 172.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.33 -33.49 74.79 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.037 1.289 . . . . 0.0 113.055 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 t -69.5 -15.34 63.23 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 173.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 67.7 mt -112.71 -30.9 6.92 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.554 1.542 . . . . 0.0 114.15 -173.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.6 m -77.59 -21.36 52.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -169.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.3 -5.19 60.53 Favored Glycine 0 CA--C 1.543 1.787 0 N-CA-C 115.284 0.874 . . . . 0.0 115.284 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -136.48 150.32 70.13 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 128.428 2.691 . . . . 0.0 106.566 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -45.9 151.49 1.38 Allowed 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.819 2.346 . . . . 0.0 112.815 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.4 t -113.49 160.25 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.224 1.41 . . . . 0.0 108.788 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.21 172.67 29.25 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 115.39 0.916 . . . . 0.0 115.39 -176.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.2 mt -134.77 113.99 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.902 1.281 . . . . 0.0 109.132 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -75.18 149.03 39.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.91 1.284 . . . . 0.0 110.008 169.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -136.8 139.35 41.71 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.326 1.45 . . . . 0.0 112.638 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.1 p -115.62 -175.49 2.73 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.248 1.819 . . . . 0.0 109.819 169.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.86 -10.37 37.52 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 173.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 94.5 p -146.15 -11.63 0.49 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -172.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -142.45 169.9 16.71 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.208 1.367 . . . . 0.0 112.47 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 35.6 p-90 -123.25 161.76 23.95 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.82 1.648 . . . . 0.0 110.323 171.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -146.71 121.7 10.04 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.176 1.39 . . . . 0.0 110.586 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.2 mm -80.94 138.39 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 95.0 mtp -137.69 144.36 41.75 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.153 0.981 . . . . 0.0 111.388 -171.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.7 m -140.61 166.31 23.95 Favored Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 127.478 2.311 . . . . 0.0 111.176 -169.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.62 167.61 9.69 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.0 2.467 . . . . 0.0 114.162 173.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.86 164.69 31.86 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.434 1.969 . . . . 0.0 110.256 169.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 85.1 tttt 59.38 -52.5 0.06 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 127.909 2.484 . . . . 0.0 115.469 -169.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 t -152.88 142.48 14.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 125.817 1.647 . . . . 0.0 112.208 -172.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -80.17 -16.65 10.92 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.435 2.757 . . . . 0.0 112.532 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 m -82.14 -5.89 58.78 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -169.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -146.95 150.33 34.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.891 1.276 . . . . 0.0 111.664 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -55.35 115.59 2.36 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.774 1.63 . . . . 0.0 112.088 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.3 tpt85 -153.29 154.47 34.67 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.519 1.528 . . . . 0.0 110.1 176.307 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -137.94 148.62 45.44 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.952 0.901 . . . . 0.0 112.823 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.4 t -150.79 144.44 17.26 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 129.633 3.173 . . . . 0.0 106.791 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -62.92 154.43 66.76 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 CA-C-N 121.795 1.677 . . . . 0.0 111.307 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.6 21.8 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -61.33 -10.22 6.73 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.02 -2.3 . . . . 0.0 114.023 177.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -65.92 -20.72 66.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.327 1.051 . . . . 0.0 113.061 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.87 -12.48 0.56 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -127.28 55.8 1.57 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.731 2.412 . . . . 0.0 108.091 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -39.88 -38.72 0.72 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 117.327 2.343 . . . . 0.0 117.327 -169.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -130.76 18.6 5.14 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.547 1.539 . . . . 0.0 112.033 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -136.85 1.51 2.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.786 1.635 . . . . 0.0 113.024 -170.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.1 p -60.85 -16.28 39.62 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.758 1.623 . . . . 0.0 115.08 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.94 138.92 39.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.357 1.463 . . . . 0.0 111.054 171.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -162.21 -179.99 7.47 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -142.97 166.2 25.29 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.769 2.428 . . . . 0.0 110.574 173.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -136.31 16.32 3.2 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -147.58 171.5 15.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.327 1.051 . . . . 0.0 113.168 -170.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -137.76 14.14 2.92 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.518 1.527 . . . . 0.0 111.715 169.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.47 11.55 0.79 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.979 1.712 . . . . 0.0 114.833 -172.609 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.4 mt -109.79 160.39 16.38 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.707 1.139 . . . . 0.0 112.879 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 64.5 m -134.79 124.41 25.11 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 127.229 2.212 . . . . 0.0 107.604 169.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -96.42 142.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.675 1.19 . . . . 0.0 109.983 -175.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -139.4 155.31 47.71 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.234 1.813 . . . . 0.0 109.74 175.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.0 mp -139.21 162.24 35.47 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.173 -0.954 . . . . 0.0 112.718 -177.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.17 145.87 14.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 126.144 1.778 . . . . 0.0 110.399 169.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -72.0 -9.58 15.84 Favored 'Cis proline' 0 CA--C 1.544 1.02 0 CA-C-N 120.575 1.241 . . . . 0.0 113.284 -8.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -64.22 173.6 1.92 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.816 1.647 . . . . 0.0 113.141 171.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -127.38 137.71 31.25 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.214 1.405 . . . . 0.0 111.191 -169.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -78.71 59.51 7.28 Favored 'Trans proline' 0 CA--C 1.549 1.254 0 C-N-CA 124.814 3.676 . . . . 0.0 112.097 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -151.43 148.04 27.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.936 1.294 . . . . 0.0 112.429 -173.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -77.85 82.61 4.22 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.352 1.072 . . . . 0.0 113.535 -177.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 64.1 p -68.02 8.6 0.39 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.147 2.179 . . . . 0.0 114.723 169.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.7 m120 60.77 21.39 11.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.664 1.986 . . . . 0.0 114.106 -175.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -145.98 168.26 12.17 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 126.891 2.076 . . . . 0.0 109.672 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.53 149.62 56.06 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 120.931 1.088 . . . . 0.0 111.388 169.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -77.46 -60.26 2.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.19 0.996 . . . . 0.0 109.883 170.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 41.0 t -84.42 142.13 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.278 1.431 . . . . 0.0 109.504 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 75.6 t -131.0 144.27 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 110.863 175.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -126.84 130.88 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.123 2.569 . . . . 0.0 109.342 -169.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.6 mt -94.13 157.05 16.25 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.428 0.632 . . . . 0.0 111.222 169.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.8 -24.36 56.9 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -71.49 -18.54 62.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.979 1.712 . . . . 0.0 113.468 176.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.72 6.0 62.57 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.575 1.083 . . . . 0.0 114.394 -175.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -84.35 142.4 30.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.416 1.108 . . . . 0.0 108.709 169.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -129.27 152.73 37.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 125.882 1.673 . . . . 0.0 110.12 -168.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.4 p -55.49 118.66 19.97 Favored Pre-proline 0 N--CA 1.471 0.6 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.259 169.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -68.42 126.46 14.24 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 121.946 1.764 . . . . 0.0 111.102 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -157.13 173.64 16.68 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.755 1.222 . . . . 0.0 112.951 -175.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -133.62 149.8 51.6 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.778 0.831 . . . . 0.0 111.053 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.1 tp -139.56 120.5 14.52 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.946 2.098 . . . . 0.0 108.364 -173.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -110.28 148.71 31.37 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.953 1.701 . . . . 0.0 110.455 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.6 mtt -126.38 134.29 51.08 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.294 1.438 . . . . 0.0 108.579 176.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -130.15 153.36 48.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.23 1.412 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.85 129.21 39.0 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.675 0.67 . . . . 0.0 110.022 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.56 -16.33 62.46 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -93.18 -53.86 1.82 Allowed Glycine 0 CA--C 1.533 1.189 0 C-N-CA 124.139 0.875 . . . . 0.0 113.101 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 63.1 p -79.03 -26.66 43.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.09 0.945 . . . . 0.0 113.283 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 76.8 3.73 80.52 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.885 1.231 . . . . 0.0 113.563 -169.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.65 131.36 61.19 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.767 1.284 . . . . 0.0 111.759 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.3 144.58 30.08 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.662 2.908 . . . . 0.0 114.273 172.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -121.71 -43.85 2.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.477 1.911 . . . . 0.0 112.071 -175.463 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -155.02 156.01 35.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.874 1.67 . . . . 0.0 108.876 -172.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.5 m -141.82 148.24 38.54 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.352 1.061 . . . . 0.0 109.426 171.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 37.0 mt -122.46 140.36 52.82 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.557 2.343 . . . . 0.0 107.64 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.2 t -143.56 130.1 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.71 0.804 . . . . 0.0 111.786 -169.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 36.0 t -117.22 115.12 24.69 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.206 1.403 . . . . 0.0 110.94 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -74.45 -10.01 59.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.447 1.099 . . . . 0.0 113.952 174.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 135.73 -0.65 3.42 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.949 1.262 . . . . 0.0 115.495 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 72.2 m -147.35 151.89 37.29 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.147 1.474 . . . . 0.0 113.301 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -60.34 135.58 91.4 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 125.469 1.508 . . . . 0.0 114.854 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -94.04 167.5 19.98 Favored 'Cis proline' 0 CA--C 1.545 1.073 0 CA-C-N 120.346 1.159 . . . . 0.0 110.398 -11.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . 0.258 0.1 OUTLIER -84.92 158.39 20.58 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.19 -0.944 . . . . 0.0 112.474 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -75.59 174.36 9.82 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.181 2.192 . . . . 0.0 113.78 -169.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -135.5 137.5 42.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.594 1.957 . . . . 0.0 110.34 169.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.8 t -152.93 162.91 40.72 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.897 1.279 . . . . 0.0 111.577 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -88.43 134.01 33.96 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.56 58.87 0.67 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.18 1.792 . . . . 0.0 115.086 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 62.54 11.06 4.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 127.209 2.204 . . . . 0.0 116.909 176.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.98 -29.47 63.28 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -169.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 81.3 p -91.92 -9.62 42.51 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.52 14.59 Favored Pre-proline 0 N--CA 1.478 0.95 0 CA-C-O 116.202 -1.856 . . . . 0.0 115.835 -174.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 C--O 1.25 1.113 0 C-N-CA 123.971 3.114 . . . . 0.0 115.18 176.776 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.61 -39.76 80.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.865 0.757 . . . . 0.0 112.629 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.46 -41.68 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.754 0.822 . . . . 0.0 110.318 176.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -49.31 78.05 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.471 0.709 . . . . 0.0 111.903 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.24 -35.35 78.66 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.306 0.957 . . . . 0.0 112.666 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.4 m -61.95 -53.22 58.73 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.016 0.826 . . . . 0.0 111.219 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -61.17 -33.33 73.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.206 1.002 . . . . 0.0 112.885 177.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.2 90.18 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.379 1.072 . . . . 0.0 113.01 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.3 mtt-85 -63.93 -42.27 97.41 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.966 0.906 . . . . 0.0 110.841 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.8 -46.23 86.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.986 0.914 . . . . 0.0 112.26 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.1 m -59.69 -42.45 93.02 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.923 1.289 . . . . 0.0 111.252 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.71 77.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.346 1.058 . . . . 0.0 113.681 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.15 97.04 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.314 -0.866 . . . . 0.0 111.537 173.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 52.4 tpt85 -64.02 -39.33 93.85 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.324 1.05 . . . . 0.0 112.427 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.82 -43.32 93.48 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.47 1.108 . . . . 0.0 113.022 170.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.1 m -60.11 -43.17 95.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.228 0.611 . . . . 0.0 110.416 176.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.97 94.97 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.069 -1.019 . . . . 0.0 113.49 171.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.7 -36.38 83.46 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.181 -0.949 . . . . 0.0 113.246 176.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.6 tp -71.45 -33.64 69.53 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.418 1.087 . . . . 0.0 111.603 174.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.02 -44.46 96.67 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.055 -1.028 . . . . 0.0 111.334 169.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -45.26 62.78 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.467 1.507 . . . . 0.0 111.74 169.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.7 -45.18 87.7 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 176.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 59.8 mt -61.65 -45.21 99.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.526 1.131 . . . . 0.0 110.831 177.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.02 -27.94 69.23 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.649 1.18 . . . . 0.0 113.271 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -92.78 -30.27 15.57 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.08 -29.92 67.69 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.2 t -77.72 -14.64 59.55 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 173.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.3 mt -106.14 -37.14 6.69 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.302 1.441 . . . . 0.0 113.651 -172.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.4 m -85.6 -7.91 58.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -173.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.17 -1.87 88.48 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 115.384 0.914 . . . . 0.0 115.384 170.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -142.15 148.36 47.87 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 127.167 2.187 . . . . 0.0 107.843 171.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -44.63 152.6 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.721 2.947 . . . . 0.0 113.942 168.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.26 161.84 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.673 1.589 . . . . 0.0 108.105 175.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.14 173.07 34.08 Favored Glycine 0 N--CA 1.465 0.615 0 CA-C-N 120.118 1.326 . . . . 0.0 115.473 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.9 mt -136.62 123.48 31.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 C-N-CA 124.583 1.153 . . . . 0.0 109.18 -177.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -88.92 151.73 22.15 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.882 1.673 . . . . 0.0 110.605 171.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -141.14 144.73 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.179 1.392 . . . . 0.0 112.676 -173.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.4 p -128.03 179.69 5.44 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.772 1.629 . . . . 0.0 110.589 170.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.7 1.45 12.29 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 121.313 -0.867 . . . . 0.0 113.254 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -138.27 -21.21 1.06 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -173.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.33 175.82 12.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.061 1.345 . . . . 0.0 112.144 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 26.7 p90 -139.0 147.8 42.62 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 126.006 1.722 . . . . 0.0 109.069 175.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -141.65 113.59 7.94 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.233 1.413 . . . . 0.0 111.284 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.0 mt -78.57 137.53 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 24.1 mtm -134.07 155.27 50.32 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.977 1.311 . . . . 0.0 110.885 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.4 p -147.18 161.76 35.3 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.654 1.182 . . . . 0.0 110.956 -168.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -59.72 144.03 99.52 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.627 2.218 . . . . 0.0 112.567 169.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -131.44 -13.67 1.85 Allowed Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.574 1.083 . . . . 0.0 115.24 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -158.21 153.45 25.69 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.298 2.239 . . . . 0.0 108.803 174.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . 0.261 15.3 t 33.4 68.06 1.05 Allowed Pre-proline 0 N--CA 1.483 1.196 0 C-N-CA 126.457 1.903 . . . . 0.0 115.999 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -52.41 -24.68 22.32 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.09 2.527 . . . . 0.0 113.949 170.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -57.12 -14.86 4.38 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.879 2.072 . . . . 0.0 115.141 171.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.28 -108.91 0.26 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.374 1.469 . . . . 0.0 111.263 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -154.05 119.59 5.19 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.236 1.414 . . . . 0.0 110.731 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.1 tpt85 -153.52 153.23 32.02 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.505 1.522 . . . . 0.0 110.384 173.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -136.42 147.06 47.07 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.453 1.101 . . . . 0.0 111.486 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -149.04 144.15 17.77 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 126.944 2.098 . . . . 0.0 108.363 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.66 131.75 42.8 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 122.745 2.296 . . . . 0.0 112.683 171.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.9 tp -67.54 99.06 0.72 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.853 1.261 . . . . 0.0 111.098 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -139.97 -7.08 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -171.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.84 -27.59 52.26 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.651 1.18 . . . . 0.0 114.142 -173.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -139.46 31.0 2.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.975 1.71 . . . . 0.0 110.897 169.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -148.61 45.15 1.03 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.849 2.46 . . . . 0.0 109.082 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.2 123.06 8.69 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.956 1.303 . . . . 0.0 112.937 -169.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.1 t70 57.66 11.21 1.22 Allowed 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 -177.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -123.32 26.98 7.7 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.408 -1.432 . . . . 0.0 113.784 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.9 p -62.66 -40.01 95.71 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.093 0.957 . . . . 0.0 112.434 169.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.16 139.96 30.62 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.333 1.053 . . . . 0.0 110.707 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -138.96 157.76 45.43 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -169.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -156.76 53.36 0.52 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.776 2.03 . . . . 0.0 110.037 -169.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 15.8 m0 -60.78 18.3 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.619 2.768 . . . . 0.0 118.358 -169.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -144.91 179.37 7.38 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.375 -1.453 . . . . 0.0 113.671 -173.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -137.23 16.82 2.98 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.51 1.524 . . . . 0.0 112.852 175.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.67 -1.26 0.7 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.8 mt -119.64 163.53 17.24 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.967 1.365 . . . . 0.0 114.436 -169.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.0 t -136.29 129.31 31.27 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 128.237 2.615 . . . . 0.0 106.949 168.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.83 137.59 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.648 1.179 . . . . 0.0 109.61 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -133.24 132.01 40.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.916 1.286 . . . . 0.0 109.58 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -116.85 145.23 43.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.691 1.196 . . . . 0.0 111.846 -169.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -145.45 151.41 47.14 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.476 1.91 . . . . 0.0 110.495 -172.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -75.92 -15.33 24.31 Favored 'Cis proline' 0 CA--C 1.543 0.953 0 CA-C-N 120.244 1.123 . . . . 0.0 112.337 -10.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -64.63 133.82 53.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.652 . . . . 0.0 111.868 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.14 147.51 90.62 Favored Pre-proline 0 CA--C 1.547 0.833 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 176.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -71.42 142.28 40.49 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.723 2.282 . . . . 0.0 109.588 169.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -154.99 -159.21 0.92 Allowed 'General case' 0 CA--C 1.549 0.936 0 O-C-N 121.507 -0.745 . . . . 0.0 112.221 -171.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -143.07 41.79 1.53 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.485 2.714 . . . . 0.0 108.106 168.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 34.9 t -65.9 154.49 39.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.764 2.026 . . . . 0.0 114.214 -169.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -69.98 -9.37 54.95 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 113.316 169.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -126.06 161.13 53.48 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 125.046 1.339 . . . . 0.0 111.548 176.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.51 158.62 43.88 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.376 2.051 . . . . 0.0 112.062 169.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -87.94 -28.93 21.19 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.692 0.797 . . . . 0.0 111.061 169.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -113.21 134.74 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.994 1.317 . . . . 0.0 109.826 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 87.6 t -133.0 140.79 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.408 1.083 . . . . 0.0 110.775 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -118.7 120.23 63.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 127.304 2.241 . . . . 0.0 108.652 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.5 mt -89.21 158.65 17.8 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.129 0.966 . . . . 0.0 111.742 176.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.17 -23.0 53.78 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -106.77 7.39 30.31 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.726 1.211 . . . . 0.0 113.932 -172.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 100.01 12.4 39.96 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 115.559 0.984 . . . . 0.0 115.559 172.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.54 ' C ' HD12 ' A' ' 105' ' ' ILE . 10.7 pt20 -98.78 140.34 33.11 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.614 1.207 . . . . 0.0 109.848 169.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.54 HD12 ' C ' ' A' ' 104' ' ' GLN . 2.9 mp -133.76 143.83 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.757 1.623 . . . . 0.0 108.068 -169.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 p -50.16 123.15 15.81 Favored Pre-proline 0 N--CA 1.475 0.779 0 C-N-CA 124.328 1.051 . . . . 0.0 111.613 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.76 123.5 13.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.675 2.25 . . . . 0.0 112.929 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.472 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.2 p90 -152.21 174.24 14.0 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.388 1.475 . . . . 0.0 111.36 176.164 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 65.7 m -145.94 146.57 31.1 Favored 'General case' 0 C--N 1.33 -0.251 0 O-C-N 121.307 -0.871 . . . . 0.0 111.373 172.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.2 tp -129.2 124.47 34.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 127.641 2.377 . . . . 0.0 108.392 -169.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -120.19 144.86 47.48 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.492 1.117 . . . . 0.0 110.118 -177.414 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.1 mtt -123.06 129.99 52.2 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 109.629 -178.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.11 138.68 52.62 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.187 1.395 . . . . 0.0 111.088 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -57.92 123.62 16.43 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.989 1.316 . . . . 0.0 111.535 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -17.81 54.92 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -116.82 -45.03 0.56 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.09 1.329 . . . . 0.0 113.943 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.0 m -73.3 -25.65 60.74 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.679 1.239 . . . . 0.0 112.338 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.9 33.35 57.68 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.022 0.82 . . . . 0.0 113.984 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -136.71 139.59 29.55 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.287 1.435 . . . . 0.0 111.375 -169.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -52.14 146.57 30.19 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.942 3.095 . . . . 0.0 114.626 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.07 -8.71 1.02 Allowed 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.0 tp -163.07 152.71 15.42 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.42 1.488 . . . . 0.0 110.308 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 1.1 m -139.71 146.24 39.35 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.642 1.577 . . . . 0.0 108.781 169.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.59 139.17 53.82 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.745 2.418 . . . . 0.0 108.829 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.9 t -137.01 128.44 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.46 0.704 . . . . 0.0 112.328 -170.039 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.472 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 52.7 t -105.64 109.41 21.36 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.305 1.442 . . . . 0.0 109.977 172.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 63.7 p -74.04 -17.35 60.98 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 143.58 -8.12 2.03 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.068 1.318 . . . . 0.0 115.034 -177.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.5 p -153.99 161.05 42.25 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.214 1.507 . . . . 0.0 113.899 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -61.73 137.89 95.19 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 125.95 1.7 . . . . 0.0 115.533 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -94.64 177.67 10.75 Favored 'Cis proline' 0 CA--C 1.547 1.157 0 CA-C-N 120.032 1.047 . . . . 0.0 110.513 -11.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.32 153.88 41.48 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.073 -1.017 . . . . 0.0 111.757 171.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -88.26 161.39 17.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.372 1.469 . . . . 0.0 109.505 169.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -138.26 140.63 39.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.621 1.568 . . . . 0.0 111.247 -169.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 2.4 t -150.36 157.46 43.07 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.81 2.044 . . . . 0.0 109.703 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -82.57 -12.31 57.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -169.56 65.94 0.05 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.152 1.381 . . . . 0.0 114.044 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.07 12.31 2.37 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 116.904 2.187 . . . . 0.0 116.904 171.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.23 -28.9 69.49 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 120.715 1.598 . . . . 0.0 113.822 -177.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 36.0 p -89.18 3.37 52.15 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.059 1.744 . . . . 0.0 113.743 175.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -115.85 85.15 14.05 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 125.99 1.716 . . . . 0.0 111.399 -170.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--O 1.25 1.091 0 C-N-CA 123.07 2.514 . . . . 0.0 112.093 172.099 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.49 -33.8 75.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 39.0 t -73.58 -44.08 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.843 0.857 . . . . 0.0 110.199 175.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.55 95.75 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 118.772 0.714 . . . . 0.0 111.904 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -56.58 -48.85 76.48 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.072 1.349 . . . . 0.0 112.509 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 176.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -59.09 -40.98 86.96 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.262 -0.875 . . . . 0.0 112.66 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.67 83.69 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.955 1.252 . . . . 0.0 111.886 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -68.32 -39.38 82.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.454 1.102 . . . . 0.0 111.457 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.57 -44.57 90.28 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.121 0.568 . . . . 0.0 112.219 171.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.1 m -60.08 -38.63 83.47 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.866 1.267 . . . . 0.0 111.589 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -44.25 81.0 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 173.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.5 98.64 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 121.349 -0.844 . . . . 0.0 112.034 174.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -60.84 -47.72 85.07 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.834 1.254 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -58.59 -43.39 89.49 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 174.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -57.84 -43.01 85.58 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.06 0.845 . . . . 0.0 111.021 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.32 89.33 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.882 -1.136 . . . . 0.0 113.722 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.84 -31.2 71.66 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.972 -1.08 . . . . 0.0 113.46 176.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 tp -70.23 -35.98 74.22 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.376 1.07 . . . . 0.0 111.498 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.43 -44.73 95.72 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.12 -0.987 . . . . 0.0 111.653 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 tp -53.67 -48.1 69.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.614 1.166 . . . . 0.0 111.393 169.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.84 -38.48 85.63 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.9 mt -64.95 -46.21 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.953 0.901 . . . . 0.0 110.935 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.81 -40.89 89.89 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.8 -0.563 . . . . 0.0 112.115 175.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -67.31 -41.61 85.06 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.464 -0.772 . . . . 0.0 112.398 173.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.07 -38.11 87.57 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.948 1.249 . . . . 0.0 112.605 176.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.38 -24.19 50.63 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.959 -0.463 . . . . 0.0 112.17 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -32.92 17.71 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.08 0.952 . . . . 0.0 113.122 177.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.9 m -79.99 -21.45 43.62 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -169.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.54 8.5 87.61 Favored Glycine 0 CA--C 1.541 1.709 0 CA-C-N 118.82 0.736 . . . . 0.0 114.616 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -144.99 149.06 41.03 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 127.584 2.354 . . . . 0.0 107.595 171.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.06 160.3 0.29 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.485 2.79 . . . . 0.0 113.719 168.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.1 t -127.56 162.24 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 126.629 1.971 . . . . 0.0 109.099 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.58 178.64 28.78 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 115.216 0.846 . . . . 0.0 115.216 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -133.59 116.63 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.793 1.237 . . . . 0.0 109.358 -172.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -85.36 68.46 10.48 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.877 2.071 . . . . 0.0 110.851 -176.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -61.65 153.1 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.716 0.806 . . . . 0.0 113.075 169.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 p -139.37 -177.05 4.75 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.308 2.243 . . . . 0.0 109.77 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -57.76 -21.98 44.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 173.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m -138.39 -4.08 1.68 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -171.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.42 176.17 10.24 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 122.361 1.077 . . . . 0.0 113.409 -176.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -154.55 161.58 41.56 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.821 2.448 . . . . 0.0 108.49 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.7 148.33 1.12 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.741 2.016 . . . . 0.0 109.879 169.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.6 mm -73.29 147.23 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.058 0.543 . . . . 0.0 109.756 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 61.6 mtp -128.65 134.58 48.57 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.094 1.358 . . . . 0.0 108.804 169.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -134.71 160.04 69.91 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 125.39 1.476 . . . . 0.0 109.878 -168.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -63.39 -24.78 71.13 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.25 1.967 . . . . 0.0 115.135 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.91 -52.76 0.05 OUTLIER Glycine 0 CA--C 1.54 1.608 0 C-N-CA 129.219 3.295 . . . . 0.0 116.738 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -144.03 -18.11 0.58 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 128.164 2.586 . . . . 0.0 112.689 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 p -131.1 69.59 82.41 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 125.099 1.36 . . . . 0.0 113.161 -169.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -71.0 27.77 0.21 Allowed 'Trans proline' 0 CA--C 1.55 1.305 0 C-N-CA 124.974 3.783 . . . . 0.0 113.763 173.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 m -71.14 -35.19 71.6 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.073 1.749 . . . . 0.0 113.932 -170.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -173.22 -44.55 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.631 1.572 . . . . 0.0 112.98 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -148.53 -66.76 0.23 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.174 0.99 . . . . 0.0 112.67 -172.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -12.41 87.73 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 129.226 3.01 . . . . 0.0 115.547 -172.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -73.69 161.03 30.71 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 36.0 t -139.72 134.48 16.12 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 128.022 2.529 . . . . 0.0 107.205 170.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -65.04 133.58 36.25 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.049 1.833 . . . . 0.0 110.167 174.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -76.46 82.02 3.17 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.802 0.811 . . . . 0.0 111.075 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -132.21 17.82 4.5 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.325 1.85 . . . . 0.0 112.584 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -58.66 -24.04 60.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.746 1.218 . . . . 0.0 114.088 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -145.43 -33.31 0.36 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.731 1.613 . . . . 0.0 112.36 173.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.9 28.36 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.989 1.715 . . . . 0.0 113.922 169.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.6 -25.55 10.96 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.617 1.967 . . . . 0.0 116.101 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -132.05 18.41 4.55 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.063 1.745 . . . . 0.0 112.603 175.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -136.86 -2.01 2.16 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.505 1.522 . . . . 0.0 113.617 -173.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 79.7 p -65.12 -14.32 60.26 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -176.032 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -135.11 162.25 33.02 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.752 1.221 . . . . 0.0 113.997 -172.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.289 48.2 t-20 40.75 -114.57 0.21 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.945 2.098 . . . . 0.0 113.434 -168.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.5 t70 56.34 8.07 0.39 Allowed 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 125.906 1.683 . . . . 0.0 114.825 -169.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 49.8 m0 -115.42 -33.76 5.16 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.621 -1.3 . . . . 0.0 112.935 -170.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 169.07 23.32 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -142.03 25.5 1.93 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.987 1.715 . . . . 0.0 111.097 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -143.33 -1.62 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -169.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 52.0 mt -117.06 165.24 13.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -169.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -133.94 131.43 39.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 128.794 2.838 . . . . 0.0 107.341 169.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -103.37 142.47 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 124.817 1.247 . . . . 0.0 109.468 -174.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -139.24 149.38 44.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.581 1.552 . . . . 0.0 109.547 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 83.9 mt -132.42 160.46 36.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.014 0.925 . . . . 0.0 112.727 -171.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.55 142.83 13.11 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.823 1.649 . . . . 0.0 110.029 169.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -73.19 -8.28 18.15 Favored 'Cis proline' 0 CA--C 1.547 1.155 0 CA-C-N 120.419 1.185 . . . . 0.0 113.516 -9.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -64.48 173.68 2.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.133 1.773 . . . . 0.0 112.891 174.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -118.16 134.39 23.36 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.228 1.411 . . . . 0.0 112.224 -175.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -78.59 74.25 5.53 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 124.123 3.215 . . . . 0.0 111.256 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -136.42 144.87 44.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.573 1.149 . . . . 0.0 111.567 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -76.34 56.17 1.05 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.351 1.461 . . . . 0.0 111.627 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.7 p -65.51 -6.46 10.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 128.479 2.712 . . . . 0.0 117.083 -169.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.68 26.08 15.84 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 113.97 -170.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -142.66 165.59 25.78 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 125.546 1.538 . . . . 0.0 109.775 169.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.96 142.74 69.91 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 121.437 1.425 . . . . 0.0 113.226 171.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.31 -13.22 18.91 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.851 2.061 . . . . 0.0 112.297 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -133.36 141.16 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.154 1.782 . . . . 0.0 108.019 173.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.4 t -133.18 144.26 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.487 1.115 . . . . 0.0 110.815 -174.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -130.2 121.16 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 127.948 2.499 . . . . 0.0 108.934 -169.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.5 157.81 31.8 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.988 1.315 . . . . 0.0 111.236 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.79 -7.81 5.69 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -178.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -115.56 8.31 15.09 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.724 1.61 . . . . 0.0 112.989 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.35 8.96 67.66 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 115.321 0.888 . . . . 0.0 115.321 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -78.84 144.4 35.05 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 169.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.3 mm -130.79 126.8 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.289 1.036 . . . . 0.0 108.763 -169.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 79.1 m -57.71 113.16 5.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -178.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -50.74 133.55 39.27 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 124.174 3.25 . . . . 0.0 115.839 -170.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.408 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.9 p90 -165.23 176.69 8.19 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.761 2.025 . . . . 0.0 111.4 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.0 t -141.15 146.15 36.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.633 1.173 . . . . 0.0 109.216 168.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tp -131.11 120.78 23.86 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 126.72 2.008 . . . . 0.0 108.704 -169.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.5 tt -112.11 148.34 34.17 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.485 1.514 . . . . 0.0 110.047 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 70.5 mtm -132.12 137.73 47.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.349 1.06 . . . . 0.0 109.372 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.42 155.89 49.82 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.94 1.696 . . . . 0.0 110.184 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -63.3 132.75 52.61 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 119.009 0.822 . . . . 0.0 110.327 173.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.21 -33.07 67.14 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -175.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.36 -47.44 3.79 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 119.016 0.825 . . . . 0.0 114.314 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.5 p -80.35 -28.05 38.17 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.81 7.57 70.33 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.887 0.756 . . . . 0.0 112.939 -169.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -71.15 128.22 90.65 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.969 1.307 . . . . 0.0 110.494 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.51 149.49 87.66 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.544 2.163 . . . . 0.0 112.008 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.25 -47.95 1.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.808 1.643 . . . . 0.0 111.884 -172.228 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.46 HD23 ' N ' ' A' ' 123' ' ' THR . 5.3 tt -153.31 149.0 27.43 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.391 1.476 . . . . 0.0 108.799 -169.524 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' THR . . . . . 0.46 ' N ' HD23 ' A' ' 122' ' ' LEU . 8.0 m -139.88 143.62 36.79 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.964 0.906 . . . . 0.0 110.085 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.3 mt -122.78 148.0 45.87 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 127.047 2.139 . . . . 0.0 108.675 -178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.7 t -142.84 135.86 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.284 0.634 . . . . 0.0 111.788 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.408 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 30.7 t -113.83 151.57 31.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.925 1.29 . . . . 0.0 111.581 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -128.64 -0.44 5.49 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.758 1.623 . . . . 0.0 113.787 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.24 -13.1 5.21 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.819 1.199 . . . . 0.0 115.381 176.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.6 t -153.04 156.07 38.06 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.478 1.639 . . . . 0.0 113.48 -174.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -55.98 137.99 72.46 Favored Pre-proline 0 CA--C 1.552 1.047 0 C-N-CA 126.738 2.015 . . . . 0.0 115.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -96.17 178.39 8.69 Favored 'Cis proline' 0 CA--C 1.55 1.283 0 CA-C-N 120.099 1.071 . . . . 0.0 110.793 -11.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.03 159.61 30.43 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.041 -1.037 . . . . 0.0 112.159 169.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -90.8 168.43 11.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.881 1.672 . . . . 0.0 109.902 169.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.455 ' HG3' HD21 ' A' ' 122' ' ' LEU . 56.1 tt0 -143.79 141.88 30.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.254 1.821 . . . . 0.0 111.847 -169.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.2 t -153.72 162.8 40.93 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.275 1.43 . . . . 0.0 111.116 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -84.75 137.12 33.39 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.593 -0.692 . . . . 0.0 109.155 170.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 23.87 65.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 127.556 2.342 . . . . 0.0 116.317 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 58.3 mtm180 57.25 9.67 0.74 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 118.043 2.608 . . . . 0.0 118.043 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -56.78 -20.73 23.94 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.467 1.485 . . . . 0.0 114.948 -175.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.83 12.29 6.23 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.596 1.558 . . . . 0.0 113.052 175.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -74.74 135.27 74.78 Favored Pre-proline 0 N--CA 1.482 1.128 0 O-C-N 120.442 -1.412 . . . . 0.0 110.032 176.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 C--O 1.249 1.069 0 C-N-CA 122.935 2.423 . . . . 0.0 113.318 171.188 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 N--CA 1.473 0.694 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -67.8 -45.51 74.59 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.889 0.875 . . . . 0.0 112.602 -176.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.8 t -63.59 -46.03 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.564 0.745 . . . . 0.0 110.44 173.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.06 78.99 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.481 0.582 . . . . 0.0 112.329 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.75 -42.85 97.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.279 0.945 . . . . 0.0 111.992 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -60.62 -46.95 88.35 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.601 1.091 . . . . 0.0 111.402 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -61.31 -36.07 79.12 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.303 -0.856 . . . . 0.0 112.474 172.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.5 88.19 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.68 1.127 . . . . 0.0 112.763 175.227 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -61.74 -41.28 97.44 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.497 0.719 . . . . 0.0 111.271 178.203 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -64.73 -52.74 55.5 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.018 0.527 . . . . 0.0 111.945 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.5 m -52.82 -41.02 63.81 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.382 1.473 . . . . 0.0 111.559 177.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.72 -48.22 69.9 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.711 1.205 . . . . 0.0 113.593 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.93 -42.46 94.01 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.663 0.665 . . . . 0.0 112.34 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -68.52 -38.01 80.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.165 0.586 . . . . 0.0 111.226 175.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -58.71 -43.85 90.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.055 -0.974 . . . . 0.0 112.724 172.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -44.31 83.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.642 1.564 . . . . 0.0 111.988 173.067 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.05 -39.7 94.65 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.349 0.977 . . . . 0.0 113.099 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.96 78.57 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.089 0.956 . . . . 0.0 113.25 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.54 -36.9 71.14 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 0.0 111.359 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.52 -44.27 96.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.963 -1.085 . . . . 0.0 111.533 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.0 tp -53.07 -45.92 68.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.198 1.399 . . . . 0.0 111.419 169.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.23 -42.04 98.95 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 176.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 75.2 mt -61.89 -47.14 94.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.877 0.871 . . . . 0.0 110.528 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.82 -34.08 75.3 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.867 0.867 . . . . 0.0 113.019 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.0 ttt85 -79.05 -35.05 43.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.667 0.787 . . . . 0.0 113.023 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.34 -25.1 67.71 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -176.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.0 t -77.55 -14.29 59.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 171.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 76.8 mt -108.01 -30.88 8.21 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.009 1.723 . . . . 0.0 113.09 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.8 p -69.23 -29.79 67.81 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.548 1.939 . . . . 0.0 115.088 -176.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.99 83.04 Favored Glycine 0 CA--C 1.542 1.729 0 C-N-CA 124.895 1.236 . . . . 0.0 114.875 -176.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -145.42 145.76 27.45 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 127.247 2.219 . . . . 0.0 107.985 171.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -40.73 139.01 1.38 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.275 2.65 . . . . 0.0 112.955 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.5 t -91.13 162.7 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.47 1.508 . . . . 0.0 108.786 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -146.82 169.41 27.95 Favored Glycine 0 CA--C 1.521 0.447 0 O-C-N 120.914 -1.116 . . . . 0.0 114.637 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.7 mt -136.06 116.6 18.08 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 125.001 1.32 . . . . 0.0 107.5 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -78.6 153.61 30.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.958 1.303 . . . . 0.0 110.688 170.24 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -141.2 142.54 33.98 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.254 1.822 . . . . 0.0 111.303 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 t -144.34 175.53 10.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.997 1.719 . . . . 0.0 111.26 -176.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -49.07 -29.77 5.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.501 1.921 . . . . 0.0 115.816 -169.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 82.4 p -140.97 14.62 2.27 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.023 1.329 . . . . 0.0 113.586 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.08 171.66 17.52 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.759 1.266 . . . . 0.0 114.355 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -138.28 160.26 39.93 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 127.771 2.428 . . . . 0.0 107.868 169.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -154.19 125.5 7.42 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.797 1.239 . . . . 0.0 110.885 -176.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 16.9 mm -72.82 142.42 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.207 -178.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -137.15 151.2 48.54 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.801 1.241 . . . . 0.0 112.25 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -145.45 167.94 13.18 Favored Pre-proline 0 N--CA 1.478 0.948 0 C-N-CA 126.248 1.819 . . . . 0.0 111.277 -169.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -60.79 -23.82 77.46 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.184 2.589 . . . . 0.0 115.866 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.12 -145.32 49.05 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 121.631 -0.668 . . . . 0.0 111.858 -169.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -73.21 1.15 9.88 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 116.635 2.087 . . . . 0.0 116.635 -174.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.6 p -125.47 38.73 0.42 Allowed Pre-proline 0 N--CA 1.485 1.309 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -61.56 -15.07 39.1 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.098 2.532 . . . . 0.0 115.282 -169.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -60.88 -15.21 28.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.455 1.502 . . . . 0.0 114.45 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -145.03 166.91 23.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.901 1.68 . . . . 0.0 111.9 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -63.62 117.91 7.48 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.052 0.941 . . . . 0.0 111.897 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -154.05 160.11 41.85 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.651 1.58 . . . . 0.0 110.528 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -139.79 142.92 36.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.665 1.186 . . . . 0.0 112.52 174.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -150.83 145.14 17.92 Favored Pre-proline 0 N--CA 1.47 0.561 0 C-N-CA 126.099 1.759 . . . . 0.0 109.126 169.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.22 147.18 36.51 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.511 2.141 . . . . 0.0 111.794 169.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.68 12.72 0.12 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -178.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -61.62 -18.41 59.33 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.175 -1.578 . . . . 0.0 113.698 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.44 -18.85 65.64 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -145.83 -16.07 0.47 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -120.43 13.58 11.84 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.04 1.336 . . . . 0.0 112.264 169.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 53.41 -168.64 0.06 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.636 2.375 . . . . 0.0 114.443 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -55.47 -16.6 3.92 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.291 -1.505 . . . . 0.0 113.967 173.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.35 3.15 9.57 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.754 2.021 . . . . 0.0 113.858 174.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -62.54 16.74 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.793 2.037 . . . . 0.0 115.367 174.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -146.73 175.18 10.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.005 1.722 . . . . 0.0 114.305 -169.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -51.48 134.2 29.18 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -173.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -150.87 16.67 0.77 Allowed 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 127.116 2.166 . . . . 0.0 111.44 169.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -88.83 -9.36 51.99 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 -169.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.7 171.79 13.58 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -136.53 9.52 3.15 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.374 1.87 . . . . 0.0 112.301 175.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -157.15 15.8 0.27 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -169.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 68.7 mt -110.66 152.96 25.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.251 -1.531 . . . . 0.0 114.102 -177.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.7 t -131.23 134.94 46.93 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.769 2.827 . . . . 0.0 106.779 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -112.12 139.07 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 125.311 1.445 . . . . 0.0 110.323 -169.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -139.14 123.31 18.0 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.163 1.385 . . . . 0.0 110.747 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.8 mp -106.25 157.22 17.75 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.33 1.062 . . . . 0.0 112.739 -177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.92 126.66 7.27 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.775 2.03 . . . . 0.0 108.846 -174.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -75.99 -9.28 27.14 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.333 1.155 . . . . 0.0 113.605 -8.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -70.29 152.15 44.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.248 1.419 . . . . 0.0 113.972 -170.317 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.54 120.94 80.51 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.249 1.42 . . . . 0.0 113.453 179.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -79.68 63.12 8.7 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.3 3.333 . . . . 0.0 111.098 170.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -157.86 154.19 27.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.0 1.72 . . . . 0.0 110.515 -174.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -56.26 66.18 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.837 2.855 . . . . 0.0 116.925 -173.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.9 t -62.9 158.33 19.35 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.851 2.06 . . . . 0.0 113.479 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -71.07 -7.01 43.52 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.168 1.387 . . . . 0.0 113.46 171.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -136.44 161.76 60.25 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.748 1.619 . . . . 0.0 111.449 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.71 142.86 44.76 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 121.628 1.552 . . . . 0.0 110.17 168.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -72.44 -22.55 61.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.471 1.109 . . . . 0.0 112.31 174.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.5 t -123.17 135.46 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.031 1.333 . . . . 0.0 109.989 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 91.9 t -131.03 144.14 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.584 1.154 . . . . 0.0 110.526 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.3 mp -128.54 123.53 59.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 127.5 2.32 . . . . 0.0 110.184 -169.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.8 mt -83.16 160.82 21.75 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.082 0.944 . . . . 0.0 112.368 175.044 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.14 62.81 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.899 1.279 . . . . 0.0 113.604 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -93.72 16.17 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.201 1.801 . . . . 0.0 112.555 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 68.97 11.62 63.67 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.658 -1.276 . . . . 0.0 115.279 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.69 143.66 34.4 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.7 mm -132.84 143.41 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.193 1.397 . . . . 0.0 108.847 -171.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.1 p -53.07 127.84 46.83 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.252 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.63 127.55 12.53 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.356 2.038 . . . . 0.0 111.344 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.53 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.2 p90 -160.31 173.76 15.2 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.236 2.214 . . . . 0.0 110.433 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.2 m -135.2 145.88 48.13 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.69 0.796 . . . . 0.0 110.894 169.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -135.52 113.8 11.47 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.692 1.997 . . . . 0.0 108.997 -169.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.7 tt -104.53 146.16 29.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.611 1.564 . . . . 0.0 110.159 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.8 mtt -119.11 133.39 55.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.955 1.302 . . . . 0.0 109.595 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -131.14 139.95 49.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.513 1.525 . . . . 0.0 111.001 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 34.8 t-20 -57.35 119.44 6.47 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.127 1.371 . . . . 0.0 111.259 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.22 -17.63 58.83 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.86 -47.21 0.91 Allowed Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.657 1.122 . . . . 0.0 113.395 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.8 m -76.63 -23.63 53.36 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.978 0.911 . . . . 0.0 112.916 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 71.08 37.0 64.13 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.41 1.005 . . . . 0.0 113.858 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -137.83 136.5 20.0 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 125.203 1.401 . . . . 0.0 111.364 -169.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -53.49 149.51 30.47 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.156 3.238 . . . . 0.0 115.184 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.65 -10.72 0.81 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 176.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -167.68 157.14 10.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.459 1.904 . . . . 0.0 109.336 178.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 19.5 m -145.81 150.19 35.73 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.759 1.224 . . . . 0.0 109.114 169.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.33 138.09 54.63 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 127.369 2.268 . . . . 0.0 108.569 -178.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.0 t -134.72 136.58 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.032 0.933 . . . . 0.0 111.322 -169.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.53 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 36.9 t -120.73 149.6 42.27 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.023 1.729 . . . . 0.0 111.337 177.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.3 p -130.06 0.77 4.73 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.432 1.493 . . . . 0.0 114.276 -177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 136.52 -11.43 4.04 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.456 1.027 . . . . 0.0 115.46 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 89.3 p -156.62 160.29 39.26 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 119.039 1.42 . . . . 0.0 114.022 -172.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 48.7 t-105 -57.39 137.72 81.34 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.832 1.653 . . . . 0.0 114.759 177.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -98.51 176.36 7.94 Favored 'Cis proline' 0 CA--C 1.549 1.232 0 CA-C-N 120.155 1.091 . . . . 0.0 111.376 -10.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.9 mp -71.35 165.13 24.38 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.168 -0.957 . . . . 0.0 110.823 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -120.33 135.48 55.0 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.15 1.38 . . . . 0.0 111.663 -176.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -88.49 149.91 23.4 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.173 1.389 . . . . 0.0 112.054 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.1 t -153.59 170.42 20.86 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.386 1.874 . . . . 0.0 110.66 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.8 mp -101.43 136.77 40.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.111 0.964 . . . . 0.0 108.83 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 35.94 54.82 0.96 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.339 1.856 . . . . 0.0 114.81 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 51.2 ptt85 43.52 33.82 0.7 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.106 2.563 . . . . 0.0 117.015 -177.316 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.28 -31.5 67.53 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 59.7 p -79.7 -5.18 54.67 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 172.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -137.4 75.76 44.79 Favored Pre-proline 0 N--CA 1.476 0.833 0 C-N-CA 125.614 1.566 . . . . 0.0 112.311 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo . . . . . 0 C--O 1.25 1.115 0 C-N-CA 124.661 3.574 . . . . 0.0 114.293 169.628 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.37 -48.93 65.29 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.934 1.694 . . . . 0.0 113.804 171.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.4 t -73.72 -45.84 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-O 118.6 -0.714 . . . . 0.0 109.948 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.21 -44.38 83.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.607 1.094 . . . . 0.0 112.673 -178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -62.49 -44.25 96.83 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.082 -1.011 . . . . 0.0 111.93 174.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.53 -50.5 72.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.012 0.525 . . . . 0.0 111.111 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -62.54 -37.44 86.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.193 0.997 . . . . 0.0 112.61 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.01 -46.47 89.37 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.128 0.876 . . . . 0.0 111.333 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.74 -37.41 82.12 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.487 1.115 . . . . 0.0 111.885 -178.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -66.08 -46.9 76.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.427 0.691 . . . . 0.0 112.442 171.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 62.7 m -63.07 -35.72 81.18 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.364 1.065 . . . . 0.0 111.281 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.53 79.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.128 1.371 . . . . 0.0 113.685 172.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.83 99.3 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.349 -0.844 . . . . 0.0 111.44 172.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -63.24 -42.55 99.23 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.583 0.753 . . . . 0.0 112.326 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -60.84 -42.31 97.52 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.888 0.767 . . . . 0.0 112.397 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.0 m -60.61 -44.2 96.56 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.419 0.688 . . . . 0.0 110.723 176.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.93 -1.106 . . . . 0.0 113.418 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.61 78.8 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.179 -0.951 . . . . 0.0 112.927 175.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.6 tp -71.3 -34.68 70.83 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.701 1.2 . . . . 0.0 112.038 172.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.1 -44.36 95.92 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.911 -1.118 . . . . 0.0 111.581 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.5 -44.7 62.59 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.438 1.495 . . . . 0.0 111.592 169.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.68 -42.99 97.97 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.284 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.46 -44.45 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 119.146 0.884 . . . . 0.0 110.758 175.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.21 -14.94 29.25 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.979 1.312 . . . . 0.0 113.795 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -112.09 -25.66 9.23 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 176.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.2 -29.6 69.92 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.062 1.301 . . . . 0.0 112.748 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -68.52 -19.15 64.5 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 173.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 pp -117.45 -24.67 7.26 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -169.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.8 m -86.22 -12.92 48.39 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.81 1.82 89.83 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.185 0.834 . . . . 0.0 115.185 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -146.8 148.76 34.15 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 127.733 2.413 . . . . 0.0 107.424 171.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -44.96 147.58 1.91 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.078 2.519 . . . . 0.0 112.868 168.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.8 t -104.48 165.23 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 126.144 1.778 . . . . 0.0 108.411 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.28 176.25 30.62 Favored Glycine 0 CA--C 1.522 0.483 0 O-C-N 120.629 -1.295 . . . . 0.0 115.479 -177.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.4 mt -133.81 121.04 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 125.145 1.378 . . . . 0.0 108.256 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -86.29 148.39 25.64 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.791 1.236 . . . . 0.0 110.482 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -134.84 149.0 50.28 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.88 1.672 . . . . 0.0 112.682 -176.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.6 t -146.0 -179.02 6.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.619 2.368 . . . . 0.0 110.105 177.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -58.22 -30.42 66.47 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 -169.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.8 m -138.48 4.54 2.4 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.823 1.249 . . . . 0.0 113.801 -179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.22 168.72 24.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.072 -1.017 . . . . 0.0 112.959 -173.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 17.8 p90 -157.06 161.85 39.48 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.737 2.015 . . . . 0.0 109.397 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 47.1 ttm-85 -155.04 145.95 22.54 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.103 1.361 . . . . 0.0 110.755 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.1 mm -64.17 146.24 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.48 1.112 . . . . 0.0 110.746 171.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 93.9 mtp -135.19 150.85 50.2 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.884 1.674 . . . . 0.0 110.701 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.7 m -142.16 161.81 48.76 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 125.82 1.648 . . . . 0.0 111.387 -170.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.03 -13.11 25.77 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.023 3.148 . . . . 0.0 116.926 -178.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 35.41 -96.83 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 C-N-CA 127.28 2.371 . . . . 0.0 116.287 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 mmmt -68.15 -29.01 67.81 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -168.57 123.4 0.76 Allowed Pre-proline 0 N--CA 1.477 0.88 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -77.15 -20.76 12.57 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.529 2.819 . . . . 0.0 112.25 169.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 t -76.25 -28.79 57.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.749 1.219 . . . . 0.0 112.796 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -130.99 17.23 5.1 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.9 t-105 60.82 76.51 0.37 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.726 2.01 . . . . 0.0 113.425 169.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.94 59.67 1.67 Allowed 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.928 -1.107 . . . . 0.0 112.667 -177.163 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -44.49 149.4 0.39 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.503 1.921 . . . . 0.0 115.509 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.0 m -142.02 157.15 64.59 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 126.125 1.77 . . . . 0.0 111.163 170.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.56 129.05 21.45 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.815 2.343 . . . . 0.0 109.967 169.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 57.4 tp -74.63 113.11 11.51 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.82 -0.55 . . . . 0.0 109.896 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -138.22 2.5 2.31 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.079 0.952 . . . . 0.0 112.628 169.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.75 -31.2 25.68 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.605 1.962 . . . . 0.0 115.616 -169.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -136.02 26.54 3.27 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.128 1.371 . . . . 0.0 112.029 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -130.27 -12.9 3.99 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.359 1.464 . . . . 0.0 113.222 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.03 -52.92 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 129.717 3.207 . . . . 0.0 114.846 -170.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -152.11 -14.21 0.18 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.723 2.409 . . . . 0.0 113.636 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.94 -1.25 3.8 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.276 -1.515 . . . . 0.0 114.19 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 97.2 p -67.93 -16.33 64.02 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.732 1.613 . . . . 0.0 114.133 170.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -84.49 -173.31 4.65 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -68.75 -119.4 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 125.493 1.517 . . . . 0.0 114.345 175.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.8 t70 60.6 16.78 6.83 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 125.758 1.623 . . . . 0.0 112.623 -167.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 30.8 m0 -77.1 -15.1 59.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.774 1.63 . . . . 0.0 113.348 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -141.32 166.64 24.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.538 1.535 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.68 -33.21 0.26 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.688 2.395 . . . . 0.0 112.116 -176.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -87.92 1.4 54.16 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.028 1.331 . . . . 0.0 113.336 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.9 mt -120.55 166.47 13.58 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 122.979 1.371 . . . . 0.0 114.635 -170.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.5 t -145.13 139.98 27.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 129.244 3.018 . . . . 0.0 106.892 169.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -117.43 146.6 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.163 0.985 . . . . 0.0 111.262 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -139.07 157.34 46.15 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.186 1.794 . . . . 0.0 109.88 175.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.24 170.54 18.73 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 172.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -160.31 161.8 24.86 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 127.819 2.447 . . . . 0.0 109.972 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.86 -15.89 5.48 Favored 'Cis proline' 0 CA--C 1.54 0.775 0 CA-C-N 121.442 1.551 . . . . 0.0 115.65 -10.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -65.43 -176.06 0.3 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.054 1.342 . . . . 0.0 112.692 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.09 147.2 57.73 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.151 0.98 . . . . 0.0 113.071 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -76.13 90.74 1.15 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.941 3.094 . . . . 0.0 110.891 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -155.42 162.31 40.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.222 1.409 . . . . 0.0 111.478 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -74.19 54.42 0.55 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.816 2.047 . . . . 0.0 114.076 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.2 m -58.65 157.01 9.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.308 1.443 . . . . 0.0 113.509 177.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -75.17 2.16 11.55 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -149.61 163.35 25.25 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 127.201 2.2 . . . . 0.0 109.652 179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -65.66 143.13 73.44 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 121.268 1.312 . . . . 0.0 109.564 168.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -73.97 -47.39 37.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.704 -0.622 . . . . 0.0 111.287 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.9 t -83.29 135.17 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.254 1.022 . . . . 0.0 109.314 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 93.8 t -134.98 144.73 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 123.777 0.831 . . . . 0.0 111.15 -178.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.01 118.89 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.034 2.534 . . . . 0.0 109.411 -169.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.6 mt -78.61 161.51 26.92 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.081 0.943 . . . . 0.0 111.692 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.48 -27.39 66.08 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.005 1.322 . . . . 0.0 113.976 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -85.85 -8.14 58.27 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.091 1.756 . . . . 0.0 113.528 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.31 7.45 60.68 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.261 0.934 . . . . 0.0 114.669 -176.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -74.19 138.54 43.83 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.546 1.173 . . . . 0.0 108.502 169.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.1 mm -129.2 150.54 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.008 1.323 . . . . 0.0 109.235 -171.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.0 p -49.22 120.71 10.26 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 124.336 1.054 . . . . 0.0 111.778 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.16 84.44 1.51 Allowed 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.445 2.763 . . . . 0.0 111.71 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -122.01 -179.52 4.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.218 1.807 . . . . 0.0 111.878 -178.17 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 m -142.29 144.51 33.3 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.142 -0.974 . . . . 0.0 112.165 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.87 144.84 48.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 128.815 2.846 . . . . 0.0 108.78 -175.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -135.6 146.75 48.25 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.373 1.469 . . . . 0.0 110.688 -178.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 56.3 mtt -123.55 131.58 53.67 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 110.005 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.79 145.3 50.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.23 1.812 . . . . 0.0 110.932 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -52.99 129.75 31.57 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.531 1.132 . . . . 0.0 110.302 172.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.4 -18.32 17.17 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.377 1.992 . . . . 0.0 116.377 -174.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.4 -37.89 0.47 Allowed Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.749 -1.028 . . . . 0.0 115.222 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 48.5 p -77.72 -26.05 49.77 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.793 1.796 . . . . 0.0 112.523 171.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.24 5.19 75.98 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.78 1.181 . . . . 0.0 114.104 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.66 124.34 90.65 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.002 1.321 . . . . 0.0 111.451 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.31 142.96 78.17 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.328 2.685 . . . . 0.0 113.292 170.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.69 -35.05 4.04 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.088 0.955 . . . . 0.0 111.555 172.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.8 tp -151.47 153.78 35.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.539 1.136 . . . . 0.0 111.055 -169.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.9 m -142.79 144.72 32.7 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 125.739 1.615 . . . . 0.0 108.814 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.3 mp -124.01 137.57 54.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.599 1.96 . . . . 0.0 108.759 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.2 t -134.49 138.39 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.124 0.97 . . . . 0.0 111.113 -169.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.8 t -116.18 117.61 30.53 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.494 1.118 . . . . 0.0 111.552 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -76.31 -8.13 56.45 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 122.19 0.94 10.46 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.481 1.515 . . . . 0.0 114.376 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 82.5 p -156.92 159.39 38.06 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.174 -1.192 . . . . 0.0 113.412 -173.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -62.51 138.43 96.54 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.997 1.719 . . . . 0.0 115.074 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -94.84 174.55 13.49 Favored 'Cis proline' 0 CA--C 1.546 1.097 0 CA-C-N 119.947 1.017 . . . . 0.0 110.812 -11.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.96 153.75 43.06 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 122.269 1.033 . . . . 0.0 110.889 169.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -100.99 116.1 32.04 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.694 1.598 . . . . 0.0 110.752 -177.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -77.22 145.42 37.6 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.401 1.081 . . . . 0.0 111.291 176.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.8 t -147.47 148.3 31.1 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.957 1.703 . . . . 0.0 110.588 169.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -72.19 132.59 44.33 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.46 -0.775 . . . . 0.0 109.434 170.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.01 66.02 0.06 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.294 2.237 . . . . 0.0 115.836 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 32.7 mtm105 56.34 21.89 5.84 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.31 -27.39 67.28 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.978 1.717 . . . . 0.0 114.791 -177.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 69.4 p -101.52 7.2 42.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.817 1.247 . . . . 0.0 113.792 169.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 19.1 tpt85 -136.59 45.19 1.16 Allowed Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 126.362 1.865 . . . . 0.0 112.971 -173.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo . . . . . 0 C--O 1.251 1.155 0 C-N-CA 124.031 3.154 . . . . 0.0 114.068 -173.505 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.9 mmm . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 120.327 0.108 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.02 163.54 37.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.322 1.449 . . . . 0.0 111.608 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -75.31 -16.76 60.39 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 69.09 25.72 75.21 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 123.965 0.793 . . . . 0.0 114.512 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.82 32.23 2.22 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.647 1.979 . . . . 0.0 111.555 -171.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -97.65 -27.19 14.48 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -169.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.51 -39.95 81.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.052 1.296 . . . . 0.0 114.493 -169.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 t -65.6 -49.2 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.869 0.868 . . . . 0.0 110.492 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.13 -38.73 88.88 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.572 0.749 . . . . 0.0 112.418 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -62.25 -41.77 98.73 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.095 0.958 . . . . 0.0 111.224 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.5 m -63.48 -48.24 78.48 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.799 -0.563 . . . . 0.0 111.619 173.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.5 mmt-85 -61.69 -32.15 72.33 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.403 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.92 76.75 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.675 1.58 . . . . 0.0 111.848 173.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.0 mtm105 -62.2 -41.15 98.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.641 0.776 . . . . 0.0 111.73 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.11 -49.4 77.45 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -35.66 76.31 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.215 1.006 . . . . 0.0 111.484 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.18 88.11 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.57 97.82 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.084 0.856 . . . . 0.0 111.86 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.0 mtt85 -62.19 -45.57 92.78 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.63 1.172 . . . . 0.0 111.707 176.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -60.78 -44.28 97.0 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.623 0.769 . . . . 0.0 112.653 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.8 m -60.55 -43.42 97.24 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.912 0.778 . . . . 0.0 110.78 178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.83 97.07 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.975 -1.078 . . . . 0.0 113.276 172.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -32.18 73.66 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.275 -0.89 . . . . 0.0 113.115 175.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.3 tp -73.56 -33.72 64.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.204 1.401 . . . . 0.0 111.786 172.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.82 -45.33 93.13 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.892 -1.13 . . . . 0.0 110.704 169.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 tp -52.2 -46.39 65.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.439 1.496 . . . . 0.0 111.324 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.64 96.92 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.81 -45.42 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.708 0.803 . . . . 0.0 110.689 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.06 -35.74 79.56 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.675 0.79 . . . . 0.0 112.815 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.338 1.055 . . . . 0.0 113.164 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.14 -37.88 88.97 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -177.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -70.01 -28.55 65.59 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 121.527 -0.733 . . . . 0.0 112.504 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.3 mt -80.72 -31.99 35.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.081 1.352 . . . . 0.0 112.971 178.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.4 m -82.21 -20.23 38.17 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -170.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.75 3.4 79.46 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -143.03 149.12 47.99 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.127 2.571 . . . . 0.0 107.175 172.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -45.54 143.51 5.89 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.647 2.231 . . . . 0.0 111.807 168.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 25.6 t -88.14 162.5 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.587 1.155 . . . . 0.0 108.716 173.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.93 176.63 23.13 Favored Glycine 0 N--CA 1.46 0.282 0 O-C-N 121.261 -0.9 . . . . 0.0 113.567 173.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.5 mt -137.3 117.18 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.672 1.189 . . . . 0.0 108.813 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -74.77 146.87 41.77 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.239 1.816 . . . . 0.0 110.473 170.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -145.17 133.99 22.36 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.403 1.481 . . . . 0.0 110.351 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -150.74 27.17 0.72 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.057 1.343 . . . . 0.0 113.442 -173.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.8 t0 63.08 -66.97 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 128.242 2.617 . . . . 0.0 113.867 -176.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 75.2 m -66.54 -24.34 66.36 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.909 0.884 . . . . 0.0 113.162 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.05 169.79 21.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.559 1.144 . . . . 0.0 112.048 174.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.5 p90 -153.98 164.41 38.47 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.596 2.758 . . . . 0.0 107.469 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -167.09 146.8 5.37 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.615 1.098 . . . . 0.0 112.713 172.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mm -66.29 152.89 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.473 0.709 . . . . 0.0 109.175 170.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.1 mtp -142.94 151.29 40.79 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.635 1.574 . . . . 0.0 111.96 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.66 164.0 37.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.432 1.893 . . . . 0.0 111.521 -169.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -63.15 167.7 12.1 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.753 2.302 . . . . 0.0 113.47 171.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -156.98 163.27 32.21 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.888 1.709 . . . . 0.0 110.67 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm 59.05 -44.46 0.07 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 128.303 2.641 . . . . 0.0 115.885 -169.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.8 t -155.08 141.63 13.26 Favored Pre-proline 0 N--CA 1.472 0.656 0 C-N-CA 125.794 1.637 . . . . 0.0 111.797 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -79.8 -16.93 11.26 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 C-N-CA 123.188 2.592 . . . . 0.0 112.442 169.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.8 m -77.66 -7.03 55.83 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -169.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.38 151.62 36.81 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.014 1.325 . . . . 0.0 111.48 178.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.3 t-105 -52.69 112.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.946 1.699 . . . . 0.0 112.452 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -152.78 157.42 40.77 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.518 1.527 . . . . 0.0 110.221 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -143.15 143.7 31.91 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -174.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -145.41 139.71 15.21 Favored Pre-proline 0 N--CA 1.472 0.639 0 C-N-CA 128.73 2.812 . . . . 0.0 107.717 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.45 130.83 24.67 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.521 2.147 . . . . 0.0 111.635 174.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -79.3 78.08 5.8 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.796 0.839 . . . . 0.0 110.914 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -136.08 25.98 3.27 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.375 1.47 . . . . 0.0 112.133 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -58.71 -25.04 62.49 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 171.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -149.95 -26.8 0.25 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.108 1.363 . . . . 0.0 113.779 169.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.95 24.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 125.411 1.484 . . . . 0.0 114.193 169.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.36 121.15 8.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.562 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 55.13 22.84 4.84 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -173.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -119.32 -30.71 4.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.484 1.514 . . . . 0.0 110.686 169.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.9 t -67.9 -21.14 65.16 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.979 1.712 . . . . 0.0 112.308 169.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -137.4 152.79 50.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.217 1.407 . . . . 0.0 114.54 -169.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 46.95 -34.58 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.179 1 C-N-CA 131.974 4.11 . . . . 0.0 120.882 169.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.76 -15.62 63.02 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -169.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -68.43 -15.07 63.42 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -146.53 171.09 15.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.374 1.07 . . . . 0.0 113.696 -176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -142.9 17.87 1.96 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.746 1.618 . . . . 0.0 112.582 172.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -144.53 0.59 1.01 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -168.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.8 mt -121.88 161.27 23.1 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -168.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.3 m -130.61 136.26 48.68 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.991 2.916 . . . . 0.0 106.685 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.93 141.53 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 125.01 1.324 . . . . 0.0 110.516 -169.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -139.08 153.42 48.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.52 1.528 . . . . 0.0 109.29 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.57 171.07 16.72 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 172.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.33 154.97 28.3 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 127.634 2.374 . . . . 0.0 109.707 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.94 -10.93 27.07 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 CA-C-N 121.368 1.524 . . . . 0.0 114.633 0.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -67.84 -171.43 0.21 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.27 1.428 . . . . 0.0 110.988 169.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.3 147.44 43.56 Favored Pre-proline 0 N--CA 1.479 0.976 0 O-C-N 120.787 -1.195 . . . . 0.0 112.82 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.1 105.23 1.15 Allowed 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.12 2.546 . . . . 0.0 109.543 174.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -160.98 137.87 8.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.885 1.274 . . . . 0.0 111.306 -169.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -69.78 46.6 0.07 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.355 2.662 . . . . 0.0 114.313 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.3 t -63.25 158.97 18.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.37 1.868 . . . . 0.0 114.159 -176.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -71.25 -5.09 29.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.974 1.31 . . . . 0.0 113.41 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -131.11 164.2 43.89 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 125.794 1.638 . . . . 0.0 111.321 176.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.02 162.12 36.78 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.45 2.1 . . . . 0.0 112.472 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -99.12 -12.22 20.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.12 1.368 . . . . 0.0 112.78 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.3 t -132.26 148.81 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 126.206 1.802 . . . . 0.0 109.398 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 73.0 t -135.49 143.09 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.77 1.228 . . . . 0.0 111.392 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -129.45 126.58 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 128.795 2.838 . . . . 0.0 109.91 -169.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.0 mt -83.98 159.81 21.16 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.123 0.963 . . . . 0.0 112.092 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.87 -26.58 67.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.2 1.4 . . . . 0.0 113.939 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -82.3 -8.6 59.64 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.651 1.58 . . . . 0.0 113.335 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.63 5.72 62.92 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.506 1.051 . . . . 0.0 114.735 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -72.01 138.83 48.23 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.507 1.154 . . . . 0.0 108.962 169.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 6.9 mm -128.05 132.9 68.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 124.558 1.143 . . . . 0.0 109.422 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.3 m -61.02 118.63 37.62 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.261 1.424 . . . . 0.0 110.431 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -52.07 132.7 44.16 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 124.017 3.144 . . . . 0.0 115.294 -176.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.432 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 8.7 p90 -162.72 174.66 12.22 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.525 1.93 . . . . 0.0 111.667 175.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.6 m -137.01 139.95 41.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.622 1.169 . . . . 0.0 109.463 169.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.2 tp -131.66 122.42 25.95 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.857 2.063 . . . . 0.0 109.01 -169.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.4 tt -118.78 144.58 46.2 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.265 1.826 . . . . 0.0 110.995 -169.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.1 mtt -123.54 128.3 49.55 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.093 1.357 . . . . 0.0 110.868 -176.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.16 139.13 54.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.071 1.349 . . . . 0.0 111.458 -178.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.516 ' HB2' HD11 ' A' ' 121' ' ' LEU . 42.5 t-20 -64.18 113.57 3.64 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.795 1.638 . . . . 0.0 110.893 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.59 -18.02 50.2 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -87.17 -17.23 59.49 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.721 1.153 . . . . 0.0 114.825 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.8 p -135.97 -28.74 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.171 1.485 . . . . 0.0 114.159 -169.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 89.64 -3.34 83.34 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.818 1.675 . . . . 0.0 113.885 -173.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -79.17 137.22 56.69 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 118.831 1.316 . . . . 0.0 112.496 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.96 142.4 42.55 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.898 2.399 . . . . 0.0 111.685 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 114' ' ' ASN . 0.2 OUTLIER -113.88 -35.18 5.2 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.717 0.807 . . . . 0.0 112.266 177.631 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.3 tp -155.74 151.55 27.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.257 1.023 . . . . 0.0 111.178 -168.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 75.6 m -139.83 152.83 46.83 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.506 1.122 . . . . 0.0 109.172 169.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.6 mt -124.66 142.53 51.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.681 2.392 . . . . 0.0 108.351 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 34.1 t -135.2 136.24 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.73 0.812 . . . . 0.0 111.969 -169.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.432 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.1 t -124.67 135.13 52.79 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.266 1.826 . . . . 0.0 110.919 -179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.1 m -131.09 7.65 4.67 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.384 1.074 . . . . 0.0 113.824 -176.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 144.73 -18.31 2.01 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.389 1.316 . . . . 0.0 116.389 172.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.3 t -157.36 155.79 31.2 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.786 1.793 . . . . 0.0 113.623 -172.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -58.59 141.8 83.75 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 115.589 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -93.18 178.34 11.88 Favored 'Cis proline' 0 CA--C 1.547 1.173 0 CA-C-N 119.757 0.949 . . . . 0.0 110.769 -11.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.89 155.77 38.65 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.107 -0.996 . . . . 0.0 111.801 169.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.07 119.81 37.36 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.231 1.412 . . . . 0.0 110.867 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -81.98 143.26 31.73 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.57 1.548 . . . . 0.0 111.323 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 3.4 t -142.75 145.01 32.87 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.013 1.325 . . . . 0.0 111.306 175.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.58 137.06 49.73 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 169.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 40.36 -97.98 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.125 1.77 . . . . 0.0 113.314 -169.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -135.35 22.18 3.43 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.524 1.53 . . . . 0.0 112.235 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.01 -21.44 21.4 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -169.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 1.2 t -120.8 11.97 11.24 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 73.91 71.34 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 125.117 1.367 . . . . 0.0 111.628 -170.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 C--O 1.251 1.132 0 C-N-CA 124.738 3.625 . . . . 0.0 114.685 175.358 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 tpt . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.545 0.212 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.05 175.09 1.31 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.949 1.299 . . . . 0.0 113.863 175.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -61.29 -22.48 64.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.699 1.2 . . . . 0.0 114.189 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.79 -38.39 0.02 OUTLIER Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.186 0.898 . . . . 0.0 114.497 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -152.31 152.84 32.62 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.097 1.359 . . . . 0.0 110.974 176.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.26 -36.6 0.65 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.408 1.883 . . . . 0.0 113.342 -175.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.34 -38.75 84.78 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.316 0.962 . . . . 0.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -63.86 -46.21 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.875 0.87 . . . . 0.0 110.679 173.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -41.75 97.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.36 0.527 . . . . 0.0 112.231 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -63.3 -44.98 93.45 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.398 0.999 . . . . 0.0 111.913 173.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -58.42 -53.04 62.81 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.308 0.643 . . . . 0.0 110.807 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.4 mmp_? -62.0 -32.96 73.48 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.299 1.039 . . . . 0.0 113.049 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.69 -50.98 69.0 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.186 1.357 . . . . 0.0 111.42 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -67.06 -36.06 81.2 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.803 -0.561 . . . . 0.0 111.455 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -63.48 -44.69 93.69 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 169.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.4 m -58.22 -41.17 83.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.361 -0.837 . . . . 0.0 111.075 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.91 -40.48 91.51 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.26 97.63 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.349 0.977 . . . . 0.0 111.954 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -62.63 -44.09 97.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.932 1.293 . . . . 0.0 111.405 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -59.27 -44.82 92.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.489 0.715 . . . . 0.0 112.417 170.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -61.34 -43.12 99.41 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.079 0.854 . . . . 0.0 111.037 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.04 99.57 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 120.784 -1.197 . . . . 0.0 113.082 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.82 -32.4 73.66 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 121.317 -0.864 . . . . 0.0 113.116 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 35.3 tp -71.13 -31.98 68.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.667 1.587 . . . . 0.0 111.783 172.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.3 -44.93 93.62 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.985 -1.072 . . . . 0.0 111.135 169.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -52.88 -46.13 67.79 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.097 1.359 . . . . 0.0 111.417 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.33 96.86 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.72 -45.61 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.241 1.016 . . . . 0.0 111.016 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -60.18 -34.48 73.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.76 0.824 . . . . 0.0 112.665 177.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -80.82 -36.07 32.09 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.98 -31.18 68.53 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.63 -11.25 60.36 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 74.5 mt -114.19 -31.6 6.27 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.363 1.865 . . . . 0.0 113.42 -173.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.8 p -72.88 -20.87 61.02 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.045 1.738 . . . . 0.0 115.563 -172.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.23 -20.32 30.51 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.637 1.113 . . . . 0.0 114.313 176.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -128.38 147.02 62.08 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 127.861 2.465 . . . . 0.0 106.925 169.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -42.26 154.04 0.12 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.86 3.04 . . . . 0.0 114.511 169.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.6 162.24 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 126.119 1.768 . . . . 0.0 108.657 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.49 178.37 33.86 Favored Glycine 0 N--CA 1.468 0.828 0 CA-C-N 120.752 1.615 . . . . 0.0 115.35 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.6 124.11 53.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.737 1.215 . . . . 0.0 110.178 177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -79.39 139.87 37.61 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 126.599 1.96 . . . . 0.0 109.433 169.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -138.39 134.53 34.26 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 125.406 1.482 . . . . 0.0 108.872 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.1 t -142.76 -175.67 4.58 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.946 1.298 . . . . 0.0 111.843 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -55.69 -26.96 47.64 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -169.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.84 -5.37 1.33 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.52 175.66 13.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.621 1.168 . . . . 0.0 112.317 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 32.4 p90 -151.8 157.95 42.63 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.451 1.901 . . . . 0.0 110.138 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.5 ttp180 -159.26 134.15 8.1 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.804 1.242 . . . . 0.0 112.39 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.2 mt -68.21 147.01 12.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 123.811 0.844 . . . . 0.0 110.114 176.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 84.4 mtp -135.99 154.46 51.07 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.942 1.697 . . . . 0.0 111.249 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 m -146.85 165.23 20.02 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 126.16 1.784 . . . . 0.0 111.256 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -62.93 159.14 39.53 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.168 1.912 . . . . 0.0 111.184 169.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -152.87 -62.16 0.01 OUTLIER Glycine 0 N--CA 1.475 1.235 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -65.63 -29.43 70.01 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.313 1.056 . . . . 0.0 113.625 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 t -154.1 137.64 10.54 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 125.102 1.361 . . . . 0.0 110.375 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -80.75 2.62 8.41 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.127 3.218 . . . . 0.0 113.193 170.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.0 m -122.43 -2.25 9.0 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -148.01 153.52 39.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.205 1.002 . . . . 0.0 111.914 173.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.8 t-105 -53.14 105.56 0.13 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.858 1.663 . . . . 0.0 114.331 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.515 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.8 tpm_? -156.05 159.01 38.75 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.999 1.72 . . . . 0.0 110.207 169.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.515 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 96.6 m95 -140.04 139.32 35.93 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.265 1.426 . . . . 0.0 112.093 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.51 154.87 73.79 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 126.907 2.083 . . . . 0.0 109.411 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.47 136.27 36.15 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.531 2.154 . . . . 0.0 112.616 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.72 -16.95 64.25 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.842 1.257 . . . . 0.0 112.869 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -48.36 -18.94 0.26 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.319 1.848 . . . . 0.0 113.438 168.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -50.75 -28.62 9.57 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.796 1.239 . . . . 0.0 113.883 169.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -139.71 0.26 1.8 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 117.119 2.266 . . . . 0.0 117.119 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.39 57.57 1.8 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.706 1.203 . . . . 0.0 109.515 169.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.68 -27.27 0.47 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 118.266 2.691 . . . . 0.0 118.266 -169.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -129.73 2.89 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 114.576 1.324 . . . . 0.0 114.576 -174.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -127.11 -13.06 5.73 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.533 1.133 . . . . 0.0 113.634 -178.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 52.1 p -73.66 -10.72 59.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.93 1.292 . . . . 0.0 114.411 172.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -121.18 177.25 5.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.031 1.732 . . . . 0.0 111.482 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -54.17 126.29 22.35 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.04 0.924 . . . . 0.0 112.954 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -157.49 29.94 0.28 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 128.993 2.917 . . . . 0.0 107.41 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -112.83 -9.32 13.67 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -167.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.39 170.21 16.42 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.391 1.076 . . . . 0.0 113.552 -175.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -138.92 2.46 2.15 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.71 1.204 . . . . 0.0 114.246 173.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -156.47 17.02 0.33 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.131 0.972 . . . . 0.0 113.444 -169.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.52 157.16 32.64 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.345 -1.472 . . . . 0.0 113.086 -169.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.8 t -135.82 142.85 44.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.854 2.062 . . . . 0.0 109.063 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.99 147.18 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.597 1.159 . . . . 0.0 111.14 -169.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -137.22 162.47 33.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.092 1.757 . . . . 0.0 110.264 173.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 73.6 mt -127.91 158.73 37.02 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.14 139.93 13.56 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 125.684 1.594 . . . . 0.0 109.227 169.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -76.4 -7.59 27.93 Favored 'Cis proline' 0 CA--C 1.545 1.043 0 CA-C-N 121.537 1.585 . . . . 0.0 113.399 -8.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -62.96 177.94 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.262 1.425 . . . . 0.0 112.167 169.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -135.78 146.68 58.1 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.6 1.16 . . . . 0.0 113.352 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -81.57 107.05 1.75 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.439 2.759 . . . . 0.0 110.115 169.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -157.77 160.01 37.39 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.087 0.955 . . . . 0.0 112.342 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.99 38.43 0.11 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 127.468 2.307 . . . . 0.0 114.02 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.8 m -59.4 156.62 12.56 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.008 1.723 . . . . 0.0 114.353 -175.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -69.6 -0.98 7.63 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.402 1.481 . . . . 0.0 114.629 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -143.58 165.19 26.28 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 127.448 2.299 . . . . 0.0 110.278 -176.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.72 155.82 64.95 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.172 1.915 . . . . 0.0 111.965 169.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -91.24 -14.95 30.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.663 1.185 . . . . 0.0 112.493 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.3 t -132.46 139.22 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 126.103 1.761 . . . . 0.0 109.078 177.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 83.1 t -133.09 147.53 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 119.443 1.02 . . . . 0.0 112.227 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -126.86 116.43 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 128.66 2.784 . . . . 0.0 108.942 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -70.83 160.32 32.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.209 1.804 . . . . 0.0 111.981 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.97 -7.05 10.03 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -121.67 10.67 10.38 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 0.0 112.992 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.95 7.86 63.91 Favored Glycine 0 CA--C 1.535 1.331 0 N-CA-C 115.963 1.145 . . . . 0.0 115.963 173.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -75.65 150.95 37.84 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.947 1.373 . . . . 0.0 107.801 169.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.5 mm -130.41 143.61 40.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 124.531 1.132 . . . . 0.0 108.939 -172.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 p -52.05 118.89 13.01 Favored Pre-proline 0 N--CA 1.473 0.699 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.1 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.78 115.06 2.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.016 2.477 . . . . 0.0 112.811 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.514 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.8 p90 -155.03 179.14 9.43 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.006 1.323 . . . . 0.0 112.908 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.9 p -143.24 152.91 42.25 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 125.331 1.452 . . . . 0.0 110.883 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.45 119.21 17.2 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 127.265 2.226 . . . . 0.0 108.806 -169.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.2 tt -110.94 145.86 37.62 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.349 1.46 . . . . 0.0 110.353 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 42.9 mtt -127.29 129.99 48.71 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.816 1.247 . . . . 0.0 110.355 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -129.99 141.71 50.72 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.528 1.531 . . . . 0.0 112.192 -171.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -61.05 109.92 1.22 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.321 1.849 . . . . 0.0 110.925 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -18.22 57.03 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -177.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.59 -16.47 68.38 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.314 0.959 . . . . 0.0 114.561 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.8 m -130.53 -27.53 2.15 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.706 1.253 . . . . 0.0 113.64 -169.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.83 36.86 40.77 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.1 0.857 . . . . 0.0 113.09 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -131.83 129.05 21.82 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.221 1.409 . . . . 0.0 111.071 -170.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.54 148.54 52.76 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.841 3.027 . . . . 0.0 114.914 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.12 -38.94 2.97 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.109 1.364 . . . . 0.0 110.973 169.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 39.9 tp -148.58 152.51 36.91 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 126.256 1.822 . . . . 0.0 110.151 -168.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.2 m -145.15 148.88 34.07 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 124.452 1.101 . . . . 0.0 108.931 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.6 mp -117.98 146.55 43.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 127.253 2.221 . . . . 0.0 108.405 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.23 141.67 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.122 0.969 . . . . 0.0 111.298 -174.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 21.9 t -120.38 121.25 38.15 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.94 1.696 . . . . 0.0 111.662 -176.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 61.7 p -74.94 -14.52 60.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.76 1.224 . . . . 0.0 114.004 170.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.33 2.77 4.02 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 125.786 1.66 . . . . 0.0 114.449 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.7 t -152.91 161.09 42.98 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.956 1.378 . . . . 0.0 113.136 -175.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -46.98 144.81 3.62 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 127.435 2.294 . . . . 0.0 113.774 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -107.87 17.25 6.93 Favored 'Cis proline' 0 CA--C 1.55 1.312 0 CA-C-N 120.744 1.301 . . . . 0.0 114.381 -2.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp 74.29 168.49 0.3 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 127.696 2.398 . . . . 0.0 112.405 -169.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -129.14 135.78 49.33 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.514 1.126 . . . . 0.0 111.558 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -82.68 155.77 24.18 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.725 1.21 . . . . 0.0 112.82 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 10.9 t -151.23 140.66 21.5 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.607 1.963 . . . . 0.0 109.976 169.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.61 130.63 43.63 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.389 -0.82 . . . . 0.0 109.383 169.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.07 63.2 0.27 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.376 1.871 . . . . 0.0 115.381 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 47.72 24.01 0.5 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 117.737 2.495 . . . . 0.0 117.737 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -57.67 -28.91 64.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -175.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.5 p -91.41 -8.15 48.7 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 175.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -63.95 -39.71 47.85 Favored Pre-proline 0 N--CA 1.478 0.975 0 CA-C-O 115.95 -1.976 . . . . 0.0 115.019 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo . . . . . 0 C--O 1.251 1.127 0 C-N-CA 124.09 3.194 . . . . 0.0 115.296 177.425 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 121.364 0.602 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.66 -172.18 0.34 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.859 1.664 . . . . 0.0 113.188 171.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -59.71 -7.84 1.77 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.077 1.751 . . . . 0.0 115.496 178.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -150.25 158.13 27.53 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 126.076 1.798 . . . . 0.0 111.076 170.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -64.19 71.66 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 127.655 2.382 . . . . 0.0 114.67 -169.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -50.16 -37.92 36.93 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.201 1.401 . . . . 0.0 112.822 171.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.46 -14.68 5.26 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.734 2.413 . . . . 0.0 114.761 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.2 t -118.13 -41.61 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.334 1.454 . . . . 0.0 110.514 170.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.39 79.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.301 0.955 . . . . 0.0 113.531 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.618 ' HA ' HD11 ' A' ' 121' ' ' LEU . 11.1 m120 -57.06 -34.93 68.75 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.188 0.904 . . . . 0.0 113.284 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.8 m -81.84 -49.85 9.89 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.183 0.993 . . . . 0.0 111.053 174.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -67.28 -26.67 66.66 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' HD12 ' A' ' 121' ' ' LEU . . . -63.9 -43.94 94.46 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.719 1.145 . . . . 0.0 111.812 169.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -67.19 -37.88 84.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.887 0.875 . . . . 0.0 110.922 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -63.06 -46.15 88.82 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.6 m -58.74 -40.91 85.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.934 0.893 . . . . 0.0 111.242 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.34 92.98 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.573 1.149 . . . . 0.0 113.297 174.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.53 96.86 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.801 . . . . 0.0 112.056 173.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.7 mtt85 -62.75 -45.65 91.7 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.561 1.144 . . . . 0.0 111.553 175.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -57.95 -45.33 86.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.727 0.811 . . . . 0.0 112.559 170.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.6 m -62.01 -43.29 99.14 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.886 0.766 . . . . 0.0 111.02 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.16 96.65 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.869 -1.144 . . . . 0.0 112.968 172.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.56 -32.14 73.57 Favored 'General case' 0 CA--C 1.547 0.842 0 O-C-N 121.346 -0.846 . . . . 0.0 113.269 175.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 tp -72.51 -34.68 67.78 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.879 1.272 . . . . 0.0 111.74 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.42 -45.09 94.68 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.969 -1.082 . . . . 0.0 110.778 169.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.89 -46.54 64.57 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.325 1.45 . . . . 0.0 110.921 169.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.16 -39.54 94.97 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.62 -46.33 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.833 0.853 . . . . 0.0 110.784 174.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.08 -38.17 87.8 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.137 0.575 . . . . 0.0 112.525 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -68.18 -34.15 75.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.402 1.081 . . . . 0.0 112.281 175.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -24.67 64.15 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.9 t -83.46 -12.32 56.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.262 0.937 . . . . 0.0 112.884 173.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.88 -27.57 9.64 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.367 1.067 . . . . 0.0 113.559 -174.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.0 m -85.12 -20.74 29.84 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.59 0.59 89.28 Favored Glycine 0 CA--C 1.542 1.724 0 N-CA-C 115.233 0.853 . . . . 0.0 115.233 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -142.35 151.11 57.22 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 127.611 2.364 . . . . 0.0 107.168 169.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -47.05 157.46 0.58 Allowed 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.912 2.408 . . . . 0.0 113.0 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 78.2 t -120.02 158.99 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.173 1.389 . . . . 0.0 108.904 -173.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.39 174.51 30.55 Favored Glycine 0 CA--C 1.519 0.327 0 O-C-N 121.316 -0.865 . . . . 0.0 115.102 -177.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.5 122.2 47.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 C-N-CA 124.774 1.23 . . . . 0.0 107.817 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -90.55 146.12 24.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.345 1.458 . . . . 0.0 110.579 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -140.88 131.71 25.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.977 1.711 . . . . 0.0 110.572 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 82.5 p -148.82 169.56 20.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.792 1.237 . . . . 0.0 112.495 175.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.14 -29.53 68.71 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 171.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 51.8 m -76.46 -49.88 15.48 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.262 1.025 . . . . 0.0 112.626 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.19 173.22 9.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.903 1.681 . . . . 0.0 112.1 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 38.5 p90 -127.62 147.43 50.36 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.328 1.451 . . . . 0.0 109.101 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.8 ptt-85 -155.62 147.54 23.32 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.31 1.044 . . . . 0.0 113.088 -169.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.5 mm -78.71 140.56 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.055 0.942 . . . . 0.0 109.209 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.7 mtp -136.17 148.53 48.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.164 0.986 . . . . 0.0 112.932 -177.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.6 m -143.79 169.67 9.92 Favored Pre-proline 0 N--CA 1.477 0.91 0 C-N-CA 127.709 2.404 . . . . 0.0 111.158 -169.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -54.81 -41.84 74.36 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.99 2.46 . . . . 0.0 114.312 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.87 -65.47 0.02 OUTLIER Glycine 0 CA--C 1.537 1.454 0 C-N-CA 127.624 2.535 . . . . 0.0 115.767 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -68.48 -54.63 15.66 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.28 1.432 . . . . 0.0 112.31 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.4 t -161.23 143.32 9.04 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 124.459 1.104 . . . . 0.0 112.296 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -79.93 -16.78 11.16 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 123.458 2.772 . . . . 0.0 112.789 169.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.8 m -73.92 -13.0 60.83 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -169.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -150.27 153.07 35.53 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.281 1.433 . . . . 0.0 111.031 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -58.24 113.18 1.82 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.859 1.264 . . . . 0.0 111.798 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.504 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.5 tpm_? -154.07 161.36 41.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.346 1.458 . . . . 0.0 110.174 174.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.504 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 92.7 m95 -139.8 139.64 36.45 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.991 1.316 . . . . 0.0 112.199 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.9 t -143.84 141.9 19.49 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 107.149 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -61.84 146.97 96.19 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 121.679 1.586 . . . . 0.0 111.065 170.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.4 tp -66.98 10.91 0.12 Allowed 'General case' 0 CA--C 1.555 1.155 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -61.85 -18.94 61.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.408 1.483 . . . . 0.0 112.729 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -62.05 -20.93 64.48 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.131 1.372 . . . . 0.0 113.987 171.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -146.27 -20.88 0.44 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 -175.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -111.41 11.86 21.5 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.493 1.117 . . . . 0.0 112.724 172.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.29 -169.25 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.181 2.192 . . . . 0.0 114.467 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -59.8 -11.11 4.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -68.37 -8.97 44.84 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.52 1.528 . . . . 0.0 113.763 170.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.0 m -63.64 8.87 0.07 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.609 1.964 . . . . 0.0 115.938 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -156.05 162.24 40.32 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.953 1.301 . . . . 0.0 114.113 -169.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.439 ' ND2' ' H ' ' A' ' 75' ' ' ASP . 7.2 t30 48.48 -158.36 0.06 Allowed 'General case' 0 CA--C 1.561 1.392 0 C-N-CA 126.902 2.081 . . . . 0.0 115.689 169.2 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.439 ' H ' ' ND2' ' A' ' 74' ' ' ASN . 1.0 OUTLIER 56.75 -6.76 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 120.669 3.581 . . . . 0.0 120.669 168.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -60.39 -21.13 61.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.853 1.661 . . . . 0.0 114.21 173.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -129.32 159.33 36.49 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.336 1.855 . . . . 0.0 112.244 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -141.88 18.53 2.14 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.37 1.068 . . . . 0.0 113.545 169.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.05 4.49 0.47 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.783 1.233 . . . . 0.0 113.993 -172.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -125.71 170.83 11.15 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.279 1.832 . . . . 0.0 111.5 -171.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 21.4 t -136.82 141.52 42.88 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.432 1.893 . . . . 0.0 109.123 169.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.64 145.6 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.348 1.459 . . . . 0.0 111.198 -169.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -141.05 152.31 44.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.197 1.799 . . . . 0.0 110.567 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.6 mt -118.96 144.8 46.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.211 1.004 . . . . 0.0 111.439 171.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -172.81 114.44 0.37 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 127.217 2.207 . . . . 0.0 110.585 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.74 156.4 4.28 Favored 'Cis proline' 0 N--CA 1.452 -0.922 0 CA-C-N 121.363 1.523 . . . . 0.0 115.586 -10.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 79.31 -171.8 0.05 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 130.299 3.44 . . . . 0.0 110.947 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.65 148.41 43.03 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 124.183 0.993 . . . . 0.0 113.078 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.06 84.86 1.91 Allowed 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.787 2.991 . . . . 0.0 111.39 175.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -142.71 142.83 32.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.93 1.292 . . . . 0.0 111.148 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -71.74 66.06 0.52 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.537 1.535 . . . . 0.0 114.155 -173.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.5 t -67.15 156.64 35.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.603 1.961 . . . . 0.0 113.661 -178.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -69.25 -8.4 45.58 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.32 1.448 . . . . 0.0 113.451 171.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -136.49 163.61 48.61 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 126.204 1.801 . . . . 0.0 111.368 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -69.88 145.47 56.52 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 121.814 1.676 . . . . 0.0 110.477 168.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.01 -49.4 24.49 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.043 0.537 . . . . 0.0 110.957 171.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.4 t -89.8 135.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.962 1.305 . . . . 0.0 109.663 -177.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.2 t -132.89 145.6 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.906 0.882 . . . . 0.0 111.644 -176.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -127.81 136.33 60.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 128.445 2.698 . . . . 0.0 109.279 -169.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.6 mt -104.97 161.37 14.26 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.772 0.796 . . . . 0.0 112.074 170.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.44 -22.17 41.7 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -170.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -103.59 5.13 36.38 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.952 1.301 . . . . 0.0 113.781 -177.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.51 8.74 57.19 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 115.552 0.981 . . . . 0.0 115.552 172.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -84.45 139.43 32.2 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.211 1.505 . . . . 0.0 108.161 169.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.9 mm -130.9 154.65 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 125.461 1.504 . . . . 0.0 109.858 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.1 p -55.73 127.93 68.46 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.857 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.74 126.85 11.08 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 122.203 1.935 . . . . 0.0 111.047 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.531 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.5 p90 -160.38 -177.41 6.21 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.905 1.682 . . . . 0.0 112.069 -177.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.58 148.68 39.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.698 0.799 . . . . 0.0 111.165 170.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.0 tp -133.17 120.35 21.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 127.929 2.492 . . . . 0.0 108.257 -170.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.5 tt -115.32 146.14 41.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.525 1.13 . . . . 0.0 110.413 -174.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 48.4 mtt -128.3 140.43 51.88 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 125.404 1.481 . . . . 0.0 109.561 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.09 147.59 49.58 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.742 1.217 . . . . 0.0 111.481 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -61.41 122.39 15.06 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.312 1.045 . . . . 0.0 109.838 173.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.18 -21.31 64.99 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -171.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -96.64 -28.57 8.83 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-N 119.119 0.872 . . . . 0.0 114.219 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 79.6 p -93.01 -27.94 16.7 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.682 1.241 . . . . 0.0 112.969 176.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.96 7.93 72.01 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.695 1.14 . . . . 0.0 113.354 -169.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -89.36 135.23 31.42 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.972 1.309 . . . . 0.0 111.401 -174.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.55 142.43 17.98 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 123.78 2.987 . . . . 0.0 113.517 172.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.618 HD11 ' HA ' ' A' ' 10' ' ' ASN . 1.4 tm? -131.86 -47.12 0.94 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 110.993 -169.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -144.64 156.61 44.19 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.069 1.748 . . . . 0.0 108.79 177.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 91.4 m -146.55 146.93 30.66 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 110.031 173.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.7 mp -123.49 146.99 47.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 127.431 2.293 . . . . 0.0 109.08 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 11.7 t -141.01 136.33 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.255 0.622 . . . . 0.0 111.912 -171.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.531 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.2 t -116.74 116.74 28.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.636 1.574 . . . . 0.0 110.594 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.8 p -78.19 -12.67 60.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.929 1.292 . . . . 0.0 114.295 173.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 131.7 -0.05 4.94 Favored Glycine 0 CA--C 1.538 1.494 0 C-N-CA 125.312 1.434 . . . . 0.0 114.701 -177.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.3 p -153.81 157.66 39.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.794 1.297 . . . . 0.0 113.648 -176.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -58.81 136.61 87.02 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 126.332 1.853 . . . . 0.0 115.135 177.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -96.14 176.27 10.26 Favored 'Cis proline' 0 CA--C 1.548 1.212 0 CA-C-N 120.193 1.105 . . . . 0.0 110.584 -11.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.21 153.18 44.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.93 -1.107 . . . . 0.0 111.73 169.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -81.14 170.47 16.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.118 1.367 . . . . 0.0 110.474 169.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -138.22 147.28 43.59 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.05 1.74 . . . . 0.0 111.391 176.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.5 t -150.41 150.12 30.96 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.552 1.541 . . . . 0.0 110.946 173.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.37 137.2 44.56 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 30.05 59.28 0.19 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.203 2.201 . . . . 0.0 115.565 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.255 23.4 ptt85 47.1 28.26 0.91 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 127.594 2.358 . . . . 0.0 117.215 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.41 -31.94 68.18 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.8 p -89.6 -2.12 58.22 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 173.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.3 86.33 19.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 125.436 1.494 . . . . 0.0 111.245 -169.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo . . . . . 0 C--O 1.25 1.09 0 C-N-CA 123.602 2.868 . . . . 0.0 113.102 169.872 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.94 174.89 13.08 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.024 1.33 . . . . 0.0 112.112 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 47.9 p90 -60.71 164.18 4.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.736 1.614 . . . . 0.0 113.84 176.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.47 -21.02 0.14 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.428 1.013 . . . . 0.0 114.574 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -144.23 149.56 36.55 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.835 1.654 . . . . 0.0 110.958 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -143.56 -16.76 0.63 Allowed 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 -173.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -65.4 -32.48 74.13 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.235 1.38 . . . . 0.0 112.613 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.11 -46.8 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.147 169.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.95 -41.98 99.67 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.024 0.829 . . . . 0.0 112.387 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -62.08 -47.52 84.28 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.763 0.825 . . . . 0.0 112.589 173.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.6 m -61.28 -52.01 66.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 122.868 0.467 . . . . 0.0 110.833 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -63.05 -34.69 78.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.404 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.62 67.84 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.657 1.571 . . . . 0.0 111.389 174.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -66.29 -42.62 88.11 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -60.52 -44.5 95.99 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.401 0.68 . . . . 0.0 112.15 171.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.9 m -57.64 -44.19 85.44 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.285 0.948 . . . . 0.0 111.424 174.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.4 -43.65 98.31 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.86 -44.05 94.29 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.645 -0.659 . . . . 0.0 112.246 175.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -65.43 -44.19 88.13 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.71 -0.619 . . . . 0.0 111.495 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.0 -41.73 92.73 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.529 0.732 . . . . 0.0 111.984 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.5 m -60.49 -42.97 97.4 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.069 0.85 . . . . 0.0 111.473 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.72 -40.71 92.47 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.833 -1.167 . . . . 0.0 113.225 173.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.97 -31.59 72.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.039 0.936 . . . . 0.0 113.005 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.0 tp -70.44 -36.85 74.19 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.789 1.236 . . . . 0.0 111.399 172.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -62.8 -44.88 94.99 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 121.056 -1.027 . . . . 0.0 111.8 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -54.07 -46.18 71.93 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.722 1.209 . . . . 0.0 111.796 170.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.49 -41.77 86.08 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 174.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.4 mt -62.41 -47.12 94.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 119.274 0.943 . . . . 0.0 110.512 173.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.05 -24.54 67.15 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.363 1.065 . . . . 0.0 113.775 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.06 -30.71 12.89 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -27.58 66.85 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 120.218 1.372 . . . . 0.0 113.691 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -74.13 -25.43 59.76 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.25 -27.45 13.19 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.38 1.072 . . . . 0.0 113.63 -173.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.7 m -86.84 -7.67 58.01 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.58 -3.06 80.5 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 124.592 1.091 . . . . 0.0 115.522 172.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -146.37 151.96 45.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 127.83 2.452 . . . . 0.0 107.294 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -42.12 153.01 0.14 Allowed 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 124.375 3.383 . . . . 0.0 115.303 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 74.3 t -110.78 162.51 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 126.331 1.852 . . . . 0.0 108.822 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.28 176.24 35.29 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 116.611 1.404 . . . . 0.0 116.611 -175.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 4.4 mp -135.24 131.01 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 125.378 1.471 . . . . 0.0 109.331 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -95.32 148.47 22.39 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.123 1.369 . . . . 0.0 110.928 173.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -138.79 143.36 38.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.079 1.752 . . . . 0.0 111.022 -173.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 77.8 p -142.05 176.37 9.01 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.734 1.614 . . . . 0.0 111.569 -173.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.94 -32.15 52.77 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.09 1.57 2.04 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -171.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.68 174.8 14.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.935 1.294 . . . . 0.0 112.598 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -143.02 159.99 41.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 127.044 2.138 . . . . 0.0 108.569 173.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -152.49 150.72 29.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.88 144.04 12.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.772 0.829 . . . . 0.0 110.431 176.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -135.39 147.89 49.19 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.754 1.622 . . . . 0.0 110.958 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.6 m -140.75 161.91 51.68 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 125.063 1.345 . . . . 0.0 110.875 -170.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -49.76 144.74 19.56 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.238 2.625 . . . . 0.0 114.751 177.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.39 -156.42 7.87 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.017 1.294 . . . . 0.0 114.145 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -53.46 -22.1 7.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -173.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.8 t -146.96 143.61 18.64 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.922 1.289 . . . . 0.0 112.158 -177.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.68 -10.98 12.94 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 123.66 2.907 . . . . 0.0 112.372 169.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.1 t -65.03 -25.31 67.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.948 1.299 . . . . 0.0 113.907 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.52 157.92 43.77 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.45 1.5 . . . . 0.0 111.209 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 44.3 t-105 -53.23 115.44 1.9 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.646 1.578 . . . . 0.0 112.079 177.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.4 tpp85 -155.89 152.22 28.03 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.241 1.416 . . . . 0.0 110.885 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -144.1 150.82 38.73 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 26.8 m -144.17 153.89 56.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 126.237 1.815 . . . . 0.0 110.191 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.31 147.84 72.85 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.137 1.891 . . . . 0.0 110.261 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.8 tp -78.16 52.98 1.15 Allowed 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.849 0.833 . . . . 0.0 111.037 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -128.83 18.71 6.15 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.442 1.497 . . . . 0.0 113.359 -169.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -63.14 -25.07 68.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.86 0.864 . . . . 0.0 113.052 172.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -149.46 -36.71 0.16 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.711 1.204 . . . . 0.0 113.406 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.74 29.46 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.645 1.578 . . . . 0.0 113.65 171.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.4 -37.63 49.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.177 1.791 . . . . 0.0 115.018 -169.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -103.59 12.09 35.37 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.466 1.507 . . . . 0.0 112.89 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -130.27 -33.74 1.68 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.752 1.221 . . . . 0.0 113.076 -172.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 75.2 m -75.63 9.15 2.41 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.186 1.394 . . . . 0.0 114.35 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -143.61 157.08 44.69 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.699 1.2 . . . . 0.0 112.67 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 40.64 -1.32 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 170.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.12 -27.83 69.35 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 121.652 2.024 . . . . 0.0 114.588 -173.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -70.06 -17.07 63.23 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.141 1.376 . . . . 0.0 113.91 -174.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -136.68 152.39 50.34 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.607 1.563 . . . . 0.0 114.161 -169.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -141.97 -6.77 0.96 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -141.98 18.34 2.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.06 1.344 . . . . 0.0 111.972 -169.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -125.9 154.88 42.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.57 1.148 . . . . 0.0 112.824 -169.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.1 m -127.47 145.37 50.86 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 127.52 2.328 . . . . 0.0 108.518 169.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -118.04 148.67 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.592 1.157 . . . . 0.0 111.108 -169.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -138.06 151.28 47.69 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.27 1.828 . . . . 0.0 109.664 172.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.2 tt -148.02 146.03 28.74 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.893 0.877 . . . . 0.0 111.439 -174.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.69 153.63 43.28 Favored Pre-proline 0 N--CA 1.472 0.646 0 C-N-CA 125.775 1.63 . . . . 0.0 111.227 176.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -81.48 -13.31 37.45 Favored 'Cis proline' 0 CA--C 1.543 0.926 0 CA-C-N 120.542 1.229 . . . . 0.0 114.426 0.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -63.46 142.75 58.28 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.78 1.232 . . . . 0.0 112.945 -176.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -59.56 112.99 6.03 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.024 1.73 . . . . 0.0 111.67 172.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -86.03 -178.78 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.228 2.618 . . . . 0.0 112.407 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.1 t70 70.96 -44.95 0.6 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 119.104 3.001 . . . . 0.0 119.104 168.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -138.77 12.7 2.7 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -170.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.6 t -56.93 150.54 16.45 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -74.08 -11.52 60.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.898 1.279 . . . . 0.0 113.252 171.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.13 162.37 58.04 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 125.354 1.462 . . . . 0.0 111.507 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -65.14 140.28 64.45 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.503 1.468 . . . . 0.0 110.306 169.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -71.01 -22.0 62.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.668 0.787 . . . . 0.0 112.509 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 62.1 t -116.33 128.19 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.883 0.873 . . . . 0.0 109.753 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.3 t -131.18 140.84 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.478 1.111 . . . . 0.0 110.554 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -126.53 124.24 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 126.575 1.95 . . . . 0.0 110.983 -169.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.7 mt -82.69 159.59 22.58 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.172 0.987 . . . . 0.0 112.041 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.35 -25.81 62.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.966 1.306 . . . . 0.0 114.345 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -87.64 -0.37 56.78 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 113.513 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.94 10.92 80.08 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.344 -0.847 . . . . 0.0 114.323 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -79.38 142.25 36.16 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.574 -0.957 . . . . 0.0 109.232 169.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -132.65 145.85 33.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 125.239 1.416 . . . . 0.0 109.094 -169.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.5 p -52.16 135.08 40.29 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 123.842 0.857 . . . . 0.0 112.286 169.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -70.78 123.48 9.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.763 2.309 . . . . 0.0 110.658 169.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.482 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 29.0 p90 -158.6 175.61 13.43 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.094 1.358 . . . . 0.0 112.14 175.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -137.68 144.72 41.94 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.227 1.411 . . . . 0.0 108.502 169.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.8 tp -136.85 116.15 12.63 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.658 1.983 . . . . 0.0 109.215 -169.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -110.42 146.35 36.02 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.953 1.301 . . . . 0.0 110.607 -175.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.4 mtt -126.11 138.24 53.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.773 1.629 . . . . 0.0 109.293 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -139.42 149.5 44.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.126 1.37 . . . . 0.0 111.69 -174.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -63.92 118.69 8.77 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.572 0.749 . . . . 0.0 110.699 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.29 -23.45 62.43 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -85.57 -17.69 61.6 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 123.873 0.749 . . . . 0.0 114.241 175.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.1 m -118.81 -24.55 6.6 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 118.21 1.005 . . . . 0.0 113.266 -169.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 64.29 33.82 88.27 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 123.604 0.621 . . . . 0.0 112.789 -171.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -125.93 127.04 24.84 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.59 1.556 . . . . 0.0 110.379 -170.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -51.74 148.01 23.02 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.204 3.269 . . . . 0.0 115.553 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.64 -51.76 1.93 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 127.101 2.16 . . . . 0.0 111.51 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -150.64 155.37 39.23 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.776 1.631 . . . . 0.0 108.637 -169.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.0 m -145.66 138.39 25.87 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 110.052 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.1 mp -111.2 149.22 31.27 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.363 2.265 . . . . 0.0 109.795 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 28.3 t -144.42 138.25 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.696 1.198 . . . . 0.0 111.871 -169.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.482 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 14.1 t -117.28 158.18 24.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.433 1.493 . . . . 0.0 112.125 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 83.0 p -133.06 -2.02 3.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.727 1.611 . . . . 0.0 114.311 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 125.3 -14.33 7.36 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.912 1.244 . . . . 0.0 115.101 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 55.7 m -142.35 152.55 43.01 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.826 1.251 . . . . 0.0 112.436 -172.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 47.5 t-105 -53.7 134.68 55.32 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.471 1.509 . . . . 0.0 114.678 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -99.9 178.2 6.05 Favored 'Cis proline' 0 CA--C 1.55 1.276 0 CA-C-N 120.53 1.225 . . . . 0.0 111.272 -11.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.461 HD21 ' CZ ' ' A' ' 108' ' ' PHE . 3.7 mp -67.76 168.6 11.11 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.191 -0.943 . . . . 0.0 112.079 169.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -114.08 164.6 13.61 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.389 1.475 . . . . 0.0 109.654 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -142.88 156.33 44.9 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.2 t -151.5 154.64 36.94 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.37 1.868 . . . . 0.0 111.084 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.01 133.82 47.64 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.494 -0.754 . . . . 0.0 109.047 169.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.82 63.1 0.13 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.646 1.978 . . . . 0.0 115.637 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 55.7 ptt85 46.46 25.77 0.43 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 127.83 2.452 . . . . 0.0 117.252 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.63 -33.62 71.74 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 -174.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.9 p -77.48 -20.95 53.59 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 20.1 mtp-105 -74.07 152.51 88.52 Favored Pre-proline 0 N--CA 1.475 0.795 0 C-N-CA 124.073 0.949 . . . . 0.0 112.768 -170.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 C--O 1.249 1.048 0 C-N-CA 123.788 2.992 . . . . 0.0 113.172 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 tpp . . . . . 0 N--CA 1.488 1.474 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.3 151.77 33.45 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.038 1.335 . . . . 0.0 111.293 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -161.14 105.99 1.35 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.958 1.703 . . . . 0.0 108.414 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -41.35 -29.52 0.4 Allowed Glycine 0 N--CA 1.482 1.715 0 C-N-CA 127.475 2.464 . . . . 0.0 118.217 -169.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.3 ttp-105 -51.76 -22.6 3.72 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.034 1.734 . . . . 0.0 113.179 169.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -51.5 -20.99 2.13 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.665 1.986 . . . . 0.0 115.511 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.16 -36.43 79.79 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.126 1.33 . . . . 0.0 112.782 170.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.8 t -70.16 -41.84 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.62 0.768 . . . . 0.0 110.127 173.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.8 -39.88 95.65 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.666 -0.646 . . . . 0.0 112.586 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -62.01 -46.34 89.62 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.682 0.793 . . . . 0.0 111.804 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.0 m -55.75 -53.81 52.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.143 0.577 . . . . 0.0 110.73 174.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.1 mmt-85 -62.12 -36.11 80.77 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 117.488 -1.244 . . . . 0.0 112.661 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.1 66.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 121.103 1.774 . . . . 0.0 111.722 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -63.87 -42.39 97.54 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.063 1.345 . . . . 0.0 111.666 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -64.79 -44.72 89.02 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.775 1.63 . . . . 0.0 112.99 174.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -62.92 -38.68 91.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.388 1.075 . . . . 0.0 111.273 175.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.09 84.24 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.57 -43.75 98.28 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.705 -0.622 . . . . 0.0 111.954 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -61.05 -48.95 79.38 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.787 1.235 . . . . 0.0 111.446 177.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -61.02 -42.29 98.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.779 -0.629 . . . . 0.0 112.399 174.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.9 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.439 1.018 . . . . 0.0 111.013 176.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.31 -42.22 99.0 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.973 -1.079 . . . . 0.0 113.396 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.1 -33.78 76.55 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.228 -0.92 . . . . 0.0 112.882 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.7 tp -71.3 -31.89 67.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.875 1.27 . . . . 0.0 111.797 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -62.97 -44.57 95.68 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.07 -1.019 . . . . 0.0 110.69 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 tp -54.02 -46.57 71.85 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.805 1.242 . . . . 0.0 111.468 169.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.0 -45.31 90.96 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.1 mt -61.98 -46.22 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 110.863 175.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -62.74 -33.37 75.0 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.933 0.893 . . . . 0.0 113.025 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -82.06 -27.03 33.18 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.247 1.019 . . . . 0.0 113.562 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.08 -38.32 85.83 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.927 1.24 . . . . 0.0 114.26 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.6 t -68.82 -32.5 72.25 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.407 -0.808 . . . . 0.0 112.144 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.86 -32.96 59.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.383 1.473 . . . . 0.0 112.804 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 75.0 m -72.23 -24.58 61.4 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.516 1.526 . . . . 0.0 114.446 -174.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.27 13.2 64.54 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 123.749 0.69 . . . . 0.0 114.153 -174.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -152.96 150.61 24.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.893 2.877 . . . . 0.0 107.178 -178.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -50.24 161.36 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.616 2.211 . . . . 0.0 112.824 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.0 t -122.55 159.65 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 125.15 1.38 . . . . 0.0 108.214 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.86 -174.8 28.02 Favored Glycine 0 N--CA 1.464 0.563 0 O-C-N 120.603 -1.31 . . . . 0.0 115.155 -176.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -125.64 127.96 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.491 1.116 . . . . 0.0 108.963 174.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -97.71 98.12 9.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.575 1.55 . . . . 0.0 108.275 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -84.85 126.55 33.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.54 1.136 . . . . 0.0 109.162 171.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 87.9 p -126.34 9.17 7.23 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -175.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 64.66 -37.46 0.21 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 128.338 2.655 . . . . 0.0 114.84 -172.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -62.66 -40.89 98.48 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.197 1.399 . . . . 0.0 111.516 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.8 -174.66 4.03 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 128.061 2.545 . . . . 0.0 109.29 169.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -147.63 135.1 20.78 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.108 -0.995 . . . . 0.0 110.492 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.37 151.28 39.07 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.769 1.228 . . . . 0.0 112.383 -173.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.1 mt -71.54 149.19 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.546 0.738 . . . . 0.0 109.142 171.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 6.0 ttt -138.55 139.53 38.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.228 1.411 . . . . 0.0 110.3 -172.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.54 164.55 30.0 Favored Pre-proline 0 N--CA 1.479 1.023 0 C-N-CA 126.492 1.917 . . . . 0.0 111.286 -169.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -68.01 164.46 31.82 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 121.787 1.658 . . . . 0.0 111.791 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.63 -59.69 0.01 OUTLIER Glycine 0 N--CA 1.472 1.066 0 CA-C-O 119.568 -0.573 . . . . 0.0 114.183 177.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -65.81 -30.78 71.46 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.272 1.036 . . . . 0.0 113.763 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.5 t -157.11 138.71 9.89 Favored Pre-proline 0 N--CA 1.471 0.616 0 C-N-CA 124.608 1.163 . . . . 0.0 110.95 169.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -87.05 4.69 6.08 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.266 3.311 . . . . 0.0 113.399 171.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.2 p -45.72 -58.54 3.38 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -162.95 -36.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.126 1.371 . . . . 0.0 113.462 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -152.84 106.22 3.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.818 0.847 . . . . 0.0 112.118 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.1 tpp85 -155.9 151.58 27.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.338 1.855 . . . . 0.0 109.607 169.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -144.54 135.83 25.36 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.7 m -143.01 151.64 56.5 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 128.255 2.622 . . . . 0.0 108.953 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.06 135.28 40.02 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 122.222 1.948 . . . . 0.0 111.095 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 tt -71.63 88.55 0.96 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.539 1.136 . . . . 0.0 109.317 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -135.74 -10.51 2.09 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -58.54 -27.68 64.76 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.651 1.114 . . . . 0.0 113.845 -177.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -135.94 24.56 3.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.454 1.902 . . . . 0.0 112.776 174.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.56 35.37 2.46 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.856 2.062 . . . . 0.0 109.718 172.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.72 118.58 4.34 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.049 1.74 . . . . 0.0 112.648 -169.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.1 t70 54.32 21.77 3.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.886 1.674 . . . . 0.0 115.101 -177.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -133.69 -12.18 2.66 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.9 t -63.87 -24.46 67.75 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.242 1.017 . . . . 0.0 113.551 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -151.6 165.61 33.77 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.762 1.225 . . . . 0.0 113.269 -177.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.74 -37.13 0.06 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 129.398 3.079 . . . . 0.0 116.66 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.91 -6.58 22.61 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.016 2.126 . . . . 0.0 113.935 173.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -42.97 -48.45 5.93 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.395 1.878 . . . . 0.0 114.574 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -158.16 -178.41 7.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.142 1.377 . . . . 0.0 112.549 -169.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -139.12 18.17 2.61 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.116 1.366 . . . . 0.0 112.922 171.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -146.93 -2.99 0.6 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.0 mt -118.08 160.08 22.12 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 -169.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.5 t -132.74 133.72 43.84 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.93 2.492 . . . . 0.0 107.802 169.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -109.66 145.62 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.542 1.137 . . . . 0.0 111.038 -169.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -136.99 155.2 50.01 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.965 1.706 . . . . 0.0 110.713 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.2 tt -145.62 147.36 31.95 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.604 1.161 . . . . 0.0 112.523 -169.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' N ' HD23 ' A' ' 84' ' ' LEU . 5.0 pp0? -154.03 153.44 28.49 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.282 1.833 . . . . 0.0 109.607 168.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -76.5 -13.62 27.25 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 120.84 1.336 . . . . 0.0 113.938 -2.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -67.85 173.15 4.64 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.339 1.056 . . . . 0.0 111.953 171.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.13 135.06 26.84 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.725 1.21 . . . . 0.0 112.449 -173.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.89 100.05 1.34 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.474 2.783 . . . . 0.0 109.87 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -159.93 141.85 13.02 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.321 1.449 . . . . 0.0 110.571 -171.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -59.83 87.05 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.736 1.214 . . . . 0.0 112.131 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.4 m -101.93 -6.57 23.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.361 1.864 . . . . 0.0 113.085 -169.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.0 20.97 4.63 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.729 2.011 . . . . 0.0 114.277 -177.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -157.29 163.47 24.83 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 127.244 2.218 . . . . 0.0 108.624 175.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.58 155.63 66.01 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 CA-C-N 120.26 1.129 . . . . 0.0 110.883 169.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -107.2 -44.88 4.25 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.088 0.555 . . . . 0.0 110.826 170.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.0 t -79.47 132.47 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.8 t -134.08 145.29 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.997 0.919 . . . . 0.0 111.865 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.72 131.53 72.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 C-N-CA 129.644 3.178 . . . . 0.0 107.984 -172.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.8 mt -96.43 157.72 15.77 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.279 0.562 . . . . 0.0 111.151 169.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.64 -22.73 47.29 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.28 -18.62 61.78 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.802 1.641 . . . . 0.0 113.507 174.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.36 5.18 63.75 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 124.933 1.254 . . . . 0.0 114.611 -176.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.29 144.25 29.84 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 118.323 1.062 . . . . 0.0 108.99 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 3.8 mm -131.47 150.27 34.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 125.334 1.454 . . . . 0.0 110.088 -168.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.6 p -57.59 121.91 52.13 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.685 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.36 127.98 28.22 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 122.736 2.29 . . . . 0.0 113.373 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -161.48 175.17 12.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.069 1.348 . . . . 0.0 112.558 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 79.1 p -136.42 150.02 48.56 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 123.749 0.82 . . . . 0.0 111.044 168.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.0 tp -130.38 106.35 8.49 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.795 2.038 . . . . 0.0 108.041 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -98.48 145.46 26.75 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.924 1.29 . . . . 0.0 110.022 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.2 mtt -128.67 128.96 45.13 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.905 1.682 . . . . 0.0 108.895 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.7 144.28 50.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 124.99 1.316 . . . . 0.0 110.764 -178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -69.61 104.54 2.4 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.089 1.356 . . . . 0.0 110.004 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.62 -20.98 66.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.625 1.17 . . . . 0.0 114.132 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -99.14 -7.19 55.2 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.775 1.179 . . . . 0.0 114.818 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.2 m -124.17 -29.11 3.62 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.579 1.152 . . . . 0.0 112.327 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 103.24 22.66 9.01 Favored Glycine 0 CA--C 1.534 1.275 0 N-CA-C 116.659 1.424 . . . . 0.0 116.659 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -140.18 143.46 33.8 Favored Pre-proline 0 N--CA 1.477 0.887 0 CA-C-N 119.491 1.645 . . . . 0.0 112.972 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.67 147.86 29.74 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.784 2.989 . . . . 0.0 113.503 169.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.87 -47.49 1.14 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.156 1.382 . . . . 0.0 112.513 -169.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -151.65 154.21 35.94 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.973 1.309 . . . . 0.0 108.954 -174.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 57.9 m -146.07 141.39 27.55 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 120.896 -1.127 . . . . 0.0 110.26 176.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.9 mp -113.35 148.95 34.73 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 126.589 1.955 . . . . 0.0 108.911 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.2 t -141.57 137.2 32.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.444 0.698 . . . . 0.0 111.875 -173.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.76 113.98 21.45 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.152 1.381 . . . . 0.0 110.94 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.7 m -75.52 -12.85 60.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 139.91 -3.09 2.5 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.851 1.215 . . . . 0.0 115.547 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 9.5 t -151.81 153.43 34.23 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.306 1.553 . . . . 0.0 112.87 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.5 t-105 -59.97 141.48 89.78 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 126.145 1.778 . . . . 0.0 115.244 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -91.44 176.05 17.44 Favored 'Cis proline' 0 CA--C 1.544 0.992 0 CA-C-N 119.793 0.962 . . . . 0.0 110.88 -11.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -67.96 152.69 45.14 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 122.226 1.012 . . . . 0.0 111.906 170.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.96 169.38 16.85 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.169 1.387 . . . . 0.0 109.523 169.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -137.51 147.21 45.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.339 1.456 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.2 t -152.13 154.57 36.14 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.247 1.419 . . . . 0.0 110.992 174.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.97 133.84 41.62 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 31.77 61.37 0.29 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.752 2.021 . . . . 0.0 115.551 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.305 0.0 OUTLIER 49.64 11.3 0.05 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 128.528 2.731 . . . . 0.0 118.209 -176.86 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.18 -34.07 63.54 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 3.2 m -91.68 -10.15 41.26 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.484 1.113 . . . . 0.0 113.288 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -64.97 -41.54 55.5 Favored Pre-proline 0 N--CA 1.478 0.961 0 CA-C-O 116.508 -1.711 . . . . 0.0 115.029 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo . . . . . 0 C--O 1.25 1.114 0 C-N-CA 124.317 3.345 . . . . 0.0 115.349 176.558 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.0 ptp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.66 172.42 13.02 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.437 1.495 . . . . 0.0 111.452 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -73.32 50.65 0.31 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.644 1.978 . . . . 0.0 114.273 -176.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -178.94 115.83 0.5 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 126.61 2.052 . . . . 0.0 110.395 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.0 ttm-85 48.81 41.02 17.59 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.299 1.44 . . . . 0.0 112.299 -169.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.19 -42.2 2.94 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 128.014 2.526 . . . . 0.0 113.306 170.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -153.74 -30.69 0.12 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.54 1.536 . . . . 0.0 112.594 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.75 -29.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -43.09 -53.24 5.02 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 117.299 2.333 . . . . 0.0 117.299 -167.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 121' ' ' LEU . 18.6 t-20 -65.51 -21.11 66.59 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.7 m -93.43 -51.95 4.74 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.221 1.409 . . . . 0.0 110.487 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 tpt85 -59.23 -33.81 71.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.012 2.125 . . . . 0.0 113.091 -177.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.05 95.11 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.434 1.47 . . . . 0.0 112.597 173.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -67.04 -41.67 86.15 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.464 1.106 . . . . 0.0 110.871 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.07 -41.46 99.44 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.635 0.774 . . . . 0.0 112.168 172.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.6 m -61.13 -41.6 97.02 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.406 1.082 . . . . 0.0 111.184 175.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.09 -41.14 91.07 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.54 91.52 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.517 -0.739 . . . . 0.0 111.884 173.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -58.47 -46.99 85.5 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.299 1.439 . . . . 0.0 111.038 174.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -63.58 -42.88 98.26 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.44 1.096 . . . . 0.0 112.688 177.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.7 m -61.7 -44.73 96.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 118.727 0.694 . . . . 0.0 110.864 176.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.25 -41.79 98.76 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.144 -0.972 . . . . 0.0 113.082 173.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.09 -31.33 70.87 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.263 -0.898 . . . . 0.0 113.374 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.6 tp -71.15 -32.79 69.37 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.482 1.113 . . . . 0.0 111.414 171.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.54 -44.01 95.45 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.913 -1.117 . . . . 0.0 110.644 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -44.75 68.34 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.048 1.339 . . . . 0.0 111.236 169.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.79 -40.63 97.93 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 176.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -64.09 -44.99 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.744 0.817 . . . . 0.0 110.718 173.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -60.6 -39.37 87.89 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.347 0.659 . . . . 0.0 112.56 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -32.82 63.18 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.378 -0.826 . . . . 0.0 112.126 174.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -36.29 83.38 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 120.121 1.328 . . . . 0.0 112.48 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -21.92 60.46 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.902 -0.499 . . . . 0.0 112.268 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.38 -28.79 14.3 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.638 1.175 . . . . 0.0 113.216 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.5 m -77.55 -28.87 52.0 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -172.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.42 9.32 84.46 Favored Glycine 0 CA--C 1.542 1.771 0 CA-C-N 119.12 0.873 . . . . 0.0 114.629 -172.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -140.76 144.34 35.51 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 127.89 2.476 . . . . 0.0 106.637 169.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.71 158.61 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.651 2.901 . . . . 0.0 114.785 169.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.0 t -115.57 164.92 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.867 2.067 . . . . 0.0 108.204 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -155.99 174.53 33.91 Favored Glycine 0 N--CA 1.465 0.611 0 CA-C-N 120.402 1.456 . . . . 0.0 115.788 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 138.04 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.55 1.14 . . . . 0.0 108.773 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -114.89 125.59 53.82 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.109 2.163 . . . . 0.0 109.299 -169.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -127.26 127.1 43.85 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 110.895 -171.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.5 t -147.19 167.08 25.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.028 1.331 . . . . 0.0 112.053 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.33 -28.02 67.63 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.409 1.083 . . . . 0.0 112.697 173.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 p -71.88 -54.19 10.84 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.034 1.334 . . . . 0.0 112.58 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.66 173.4 13.94 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.356 2.262 . . . . 0.0 110.336 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -136.25 153.36 51.22 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.939 0.896 . . . . 0.0 111.508 169.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.8 ptp85 -158.28 163.21 37.61 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.822 1.249 . . . . 0.0 113.955 -170.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.9 mt -92.91 144.89 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.929 0.891 . . . . 0.0 109.724 170.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 92.0 mtp -134.45 149.79 50.78 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.964 1.706 . . . . 0.0 110.645 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.0 p -141.62 156.07 66.54 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.979 1.711 . . . . 0.0 111.299 -168.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -58.31 -29.99 89.65 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.085 2.523 . . . . 0.0 114.066 169.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 67.4 -68.47 0.25 Allowed Glycine 0 CA--C 1.529 0.942 0 C-N-CA 127.466 2.46 . . . . 0.0 115.496 169.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -135.6 -20.75 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.345 1.858 . . . . 0.0 114.436 -169.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.48 48.01 3.04 Favored Pre-proline 0 N--CA 1.485 1.281 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -169.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -65.82 4.69 0.79 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 123.973 3.115 . . . . 0.0 114.741 178.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.0 m -44.88 -33.79 2.1 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 129.184 2.994 . . . . 0.0 115.573 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -154.04 -51.65 0.1 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.552 1.141 . . . . 0.0 111.749 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.8 t-105 -158.91 125.3 4.58 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.478 1.511 . . . . 0.0 110.468 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -152.65 154.13 34.71 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.234 1.413 . . . . 0.0 111.14 174.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -141.87 151.0 42.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.823 1.249 . . . . 0.0 112.534 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.3 p -159.45 149.54 15.16 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 127.992 2.517 . . . . 0.0 108.12 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.28 140.22 42.77 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.577 2.185 . . . . 0.0 112.813 169.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.74 64.27 2.98 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.272 1.029 . . . . 0.0 110.371 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -131.05 5.65 4.53 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.658 1.583 . . . . 0.0 113.086 -170.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -62.03 -18.21 59.84 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.655 1.182 . . . . 0.0 113.961 176.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -133.85 -33.09 1.07 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.162 1.385 . . . . 0.0 113.026 173.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.82 -11.94 61.05 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 174.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.32 -55.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 129.934 3.294 . . . . 0.0 116.574 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.5 -15.15 0.24 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.778 1.631 . . . . 0.0 113.894 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -62.42 -21.29 65.29 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 120.801 -1.187 . . . . 0.0 114.085 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.0 m -76.65 -2.3 32.02 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.455 1.502 . . . . 0.0 114.735 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -141.22 165.42 27.58 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.107 1.322 . . . . 0.0 112.863 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 41.2 t30 47.73 -52.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 130.362 3.465 . . . . 0.0 119.684 169.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -55.46 -13.68 1.61 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 127.412 2.285 . . . . 0.0 113.442 169.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 28.6 m95 -43.07 -30.26 0.42 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 115.604 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -149.17 154.88 39.81 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.928 1.24 . . . . 0.0 112.972 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -145.62 -19.64 0.47 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -177.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -136.99 16.35 3.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.548 1.539 . . . . 0.0 111.311 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -129.61 156.45 44.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.944 1.698 . . . . 0.0 110.532 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.2 m -125.44 130.65 52.26 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.288 1.835 . . . . 0.0 109.013 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.97 139.3 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.594 1.158 . . . . 0.0 110.06 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 -137.48 122.18 18.64 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.505 1.522 . . . . 0.0 109.357 -176.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.15 145.11 42.1 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.972 1.309 . . . . 0.0 111.994 -169.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -156.62 153.48 24.78 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.364 1.865 . . . . 0.0 110.19 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -75.02 -15.22 22.56 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 CA-C-N 120.347 1.16 . . . . 0.0 113.69 -3.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -61.06 125.57 24.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.202 1.001 . . . . 0.0 111.801 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 134.72 89.61 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 124.183 0.993 . . . . 0.0 112.52 177.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.98 108.64 2.36 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.049 2.5 . . . . 0.0 109.627 172.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -159.51 145.93 16.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.473 1.109 . . . . 0.0 111.851 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.85 48.22 0.46 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.446 1.498 . . . . 0.0 112.618 174.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.8 m -58.31 156.18 10.44 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.903 1.681 . . . . 0.0 113.207 -176.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -67.8 5.09 0.93 Allowed 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -159.45 164.35 20.82 Favored Pre-proline 0 CA--C 1.542 0.649 0 C-N-CA 127.346 2.258 . . . . 0.0 109.889 -176.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.89 149.68 83.13 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 121.407 1.405 . . . . 0.0 110.01 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -94.1 -42.81 8.8 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.039 -0.413 . . . . 0.0 111.987 176.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -73.79 138.53 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.227 1.011 . . . . 0.0 109.194 169.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 85.5 t -136.13 144.94 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.717 0.807 . . . . 0.0 111.772 -176.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.45 118.0 48.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 128.885 2.874 . . . . 0.0 108.072 -173.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.7 mt -82.53 163.41 21.54 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 122.275 1.036 . . . . 0.0 111.952 177.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.88 -13.69 11.99 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -176.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -120.12 9.44 11.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.561 . . . . 0.0 113.308 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.31 9.25 58.12 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 115.788 1.075 . . . . 0.0 115.788 174.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -75.49 136.56 40.63 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.942 1.371 . . . . 0.0 108.178 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.2 mm -130.14 144.69 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.706 1.203 . . . . 0.0 109.551 -172.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.6 p -54.75 133.56 65.44 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 121.656 -0.653 . . . . 0.0 110.931 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.49 98.49 1.18 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.506 2.137 . . . . 0.0 111.466 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 22.4 p90 -124.48 177.28 6.0 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.045 1.738 . . . . 0.0 111.945 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.2 t -140.26 145.57 37.49 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.802 1.241 . . . . 0.0 110.299 172.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 7.7 tp -130.45 92.14 3.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.128 2.171 . . . . 0.0 109.602 -169.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.1 tt -80.75 143.73 32.69 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.962 0.905 . . . . 0.0 109.921 176.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 63.2 mtt -127.31 133.11 50.15 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 126.028 1.731 . . . . 0.0 108.309 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.46 143.49 51.17 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.907 1.283 . . . . 0.0 110.693 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -66.92 109.46 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.764 0.826 . . . . 0.0 110.901 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.37 64.57 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.88 -0.04 75.57 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 125.653 1.597 . . . . 0.0 114.429 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -129.85 -37.45 1.53 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.704 1.201 . . . . 0.0 113.143 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 88.49 30.18 16.82 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 118.515 0.598 . . . . 0.0 114.014 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -141.65 139.67 18.95 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.123 1.369 . . . . 0.0 111.225 -169.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -49.61 144.63 18.93 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.912 3.075 . . . . 0.0 114.182 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.466 HD11 ' HA ' ' A' ' 10' ' ' ASN . 1.5 tm? -130.68 -50.08 1.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 110.603 -169.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.47 162.84 33.48 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.74 1.616 . . . . 0.0 110.174 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 9.4 m -147.99 117.51 7.01 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 123.882 0.873 . . . . 0.0 109.188 176.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.5 mp -92.4 149.51 21.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.8 1.24 . . . . 0.0 109.918 173.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.07 136.45 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.417 1.087 . . . . 0.0 112.056 -169.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 18.0 t -120.62 160.26 23.61 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.905 1.682 . . . . 0.0 111.442 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 82.1 p -137.72 -0.4 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -174.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.34 -11.6 5.8 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.613 1.102 . . . . 0.0 115.004 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.2 p -157.6 158.67 36.0 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.235 -1.156 . . . . 0.0 113.513 -173.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' TRP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 131' ' ' PRO . 29.6 t-105 -60.69 140.11 92.95 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 126.309 1.843 . . . . 0.0 114.991 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 130' ' ' TRP . 42.6 Cg_endo -96.1 176.98 9.71 Favored 'Cis proline' 0 CA--C 1.546 1.114 0 CA-C-N 119.969 1.025 . . . . 0.0 111.281 -11.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.9 mp -69.35 168.14 14.98 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.133 0.968 . . . . 0.0 111.096 169.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -114.71 164.29 14.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.158 1.383 . . . . 0.0 109.434 169.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -140.46 149.83 43.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.362 1.065 . . . . 0.0 112.484 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.1 t -145.62 150.28 36.06 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.149 1.38 . . . . 0.0 111.181 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.85 132.19 46.35 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.781 -0.574 . . . . 0.0 109.478 169.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.91 66.37 0.07 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.472 2.309 . . . . 0.0 115.939 176.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.76 7.81 4.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 175.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -57.74 -31.28 66.32 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 116.31 1.967 . . . . 0.0 116.31 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.9 p -99.09 -6.33 28.59 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -63.64 -35.77 18.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 117.277 2.325 . . . . 0.0 117.277 -169.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo . . . . . 0 C--O 1.25 1.094 0 C-N-CA 124.111 3.207 . . . . 0.0 115.307 177.865 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.13 -11.53 6.29 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -176.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -75.22 -23.24 57.56 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.093 1.357 . . . . 0.0 113.528 173.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.25 67.51 1.47 Allowed Glycine 0 CA--C 1.532 1.132 0 C-N-CA 127.002 2.239 . . . . 0.0 115.017 -169.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -118.57 7.94 11.89 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.126 1.771 . . . . 0.0 113.241 -173.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -50.04 -37.38 32.97 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 -169.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -71.12 -41.11 70.95 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.836 1.198 . . . . 0.0 112.767 176.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 46.4 t -66.96 -45.01 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.693 0.797 . . . . 0.0 109.825 173.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.69 90.83 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.105 0.962 . . . . 0.0 112.512 176.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -63.11 -49.28 75.03 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.749 1.159 . . . . 0.0 111.671 172.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.2 m -57.77 -52.41 65.59 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.136 0.574 . . . . 0.0 110.584 177.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -65.48 -30.75 71.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.685 1.194 . . . . 0.0 113.728 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.35 -48.75 78.43 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.743 1.61 . . . . 0.0 110.778 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -66.41 -38.94 88.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.887 1.275 . . . . 0.0 111.513 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.53 -46.06 87.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.612 0.765 . . . . 0.0 112.191 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.3 m -57.56 -40.08 78.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.857 0.863 . . . . 0.0 111.27 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.06 -44.58 84.11 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.46 -43.51 97.15 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.357 -0.839 . . . . 0.0 111.913 174.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -62.15 -45.56 92.91 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.948 1.699 . . . . 0.0 111.515 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -59.13 -47.46 85.21 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.463 1.105 . . . . 0.0 112.242 170.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.5 m -58.24 -41.56 84.45 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 118.871 0.759 . . . . 0.0 110.725 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.32 -41.02 94.44 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.051 -1.031 . . . . 0.0 113.715 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.23 -32.78 74.5 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.148 -0.97 . . . . 0.0 113.094 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.3 tp -74.08 -35.11 64.2 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.848 1.259 . . . . 0.0 111.602 174.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.53 -46.25 90.75 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.994 -1.066 . . . . 0.0 111.067 169.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 tp -51.98 -47.45 64.85 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.322 1.449 . . . . 0.0 111.262 169.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.43 85.93 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.9 mt -66.05 -47.95 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.411 1.005 . . . . 0.0 110.659 174.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -59.83 -39.24 84.4 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.807 -0.558 . . . . 0.0 112.007 175.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -69.17 -38.72 78.86 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.362 -0.836 . . . . 0.0 112.391 175.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.26 73.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.449 1.022 . . . . 0.0 112.712 174.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.08 -20.41 55.79 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.687 0.676 . . . . 0.0 112.551 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.48 -27.19 14.17 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.613 1.165 . . . . 0.0 113.702 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.7 m -89.83 -14.03 35.28 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -169.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.34 -1.36 81.67 Favored Glycine 0 CA--C 1.542 1.723 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -140.83 149.98 58.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 127.861 2.464 . . . . 0.0 107.25 172.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -45.95 164.67 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 124.305 3.337 . . . . 0.0 115.528 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.8 t -123.12 159.3 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.431 1.893 . . . . 0.0 108.353 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.35 -178.79 32.71 Favored Glycine 0 N--CA 1.465 0.574 0 O-C-N 120.721 -1.237 . . . . 0.0 115.402 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.8 mt -131.27 111.95 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.42 1.088 . . . . 0.0 110.333 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -83.36 78.29 9.66 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.206 1.803 . . . . 0.0 110.269 175.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -64.99 120.36 12.46 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 168.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 t -125.99 -179.6 4.77 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.25 1.42 . . . . 0.0 113.079 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.34 -24.78 68.0 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -169.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.1 m -135.08 -9.72 2.29 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -175.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -161.16 -175.68 5.01 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.959 2.104 . . . . 0.0 109.365 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -136.6 151.48 49.38 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.302 1.041 . . . . 0.0 109.583 169.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -141.08 151.34 43.92 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.2 mm -76.65 137.33 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 169.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.1 mtm -128.89 150.4 50.37 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.049 1.34 . . . . 0.0 111.371 175.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.65 163.28 51.74 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 126.98 2.112 . . . . 0.0 111.261 -168.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -54.49 160.95 6.24 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 124.085 3.19 . . . . 0.0 114.825 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -120.22 -136.35 5.17 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.587 1.089 . . . . 0.0 113.715 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -46.54 -35.79 6.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 126.37 1.868 . . . . 0.0 114.68 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 t -146.45 142.13 17.09 Favored Pre-proline 0 N--CA 1.47 0.572 0 C-N-CA 124.805 1.242 . . . . 0.0 111.696 174.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.6 -10.0 14.59 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.488 2.792 . . . . 0.0 112.55 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 t -71.13 -17.3 62.57 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.057 1.343 . . . . 0.0 114.157 -173.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.62 163.7 33.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.489 1.516 . . . . 0.0 111.611 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.0 t-105 -58.32 112.4 1.55 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.844 1.257 . . . . 0.0 111.911 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.1 tpt85 -157.04 143.18 17.96 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.699 1.599 . . . . 0.0 109.992 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -136.52 153.63 50.96 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.553 1.141 . . . . 0.0 112.81 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.4 t -150.3 140.33 13.86 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 128.079 2.552 . . . . 0.0 108.366 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -51.46 145.32 29.1 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.474 2.116 . . . . 0.0 111.787 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.4 tp -66.44 12.7 0.06 Allowed 'General case' 0 CA--C 1.554 1.134 0 O-C-N 120.576 -1.328 . . . . 0.0 114.185 176.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -64.93 -7.77 12.9 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.998 -1.688 . . . . 0.0 113.576 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -57.46 -25.78 60.23 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.031 1.333 . . . . 0.0 112.122 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -137.21 -42.19 0.57 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.607 1.163 . . . . 0.0 112.964 170.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.35 48.3 1.01 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.014 1.325 . . . . 0.0 111.492 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.31 -34.66 10.88 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.707 1.603 . . . . 0.0 115.099 -169.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -123.92 13.5 9.16 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.743 2.017 . . . . 0.0 113.286 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -133.39 -5.16 2.97 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.242 1.417 . . . . 0.0 113.942 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.0 t -54.88 -34.29 62.83 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.263 1.025 . . . . 0.0 112.819 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -118.91 140.21 50.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.62 1.568 . . . . 0.0 112.506 178.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 23.83 -115.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 127.429 2.292 . . . . 0.0 114.152 -169.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.0 t70 54.41 29.92 11.84 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.351 1.46 . . . . 0.0 113.718 -169.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -115.85 -21.25 9.66 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.972 1.709 . . . . 0.0 113.21 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -141.6 170.65 15.33 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.952 1.301 . . . . 0.0 113.537 -175.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -143.0 8.24 1.65 Allowed 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 169.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.36 9.41 1.08 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 125.053 1.341 . . . . 0.0 114.213 -175.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.96 160.86 23.96 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.414 -1.429 . . . . 0.0 112.097 -169.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.6 m -128.78 134.47 48.4 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 126.759 2.024 . . . . 0.0 108.825 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -104.61 146.98 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 124.292 1.037 . . . . 0.0 110.226 -173.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -138.18 160.9 38.21 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.663 1.985 . . . . 0.0 109.81 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.97 160.84 28.93 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.664 1.186 . . . . 0.0 112.424 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -148.0 130.58 7.8 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.948 2.099 . . . . 0.0 108.284 176.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -79.0 -5.21 37.48 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 CA-C-N 121.671 1.633 . . . . 0.0 113.146 -10.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -65.99 -178.83 0.65 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.177 1.791 . . . . 0.0 112.724 176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.6 138.87 25.44 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 124.485 1.114 . . . . 0.0 112.897 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.72 99.88 1.2 Allowed 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.72 2.947 . . . . 0.0 109.704 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -156.46 154.39 30.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.663 1.185 . . . . 0.0 111.67 -169.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -76.06 53.08 0.76 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.925 1.69 . . . . 0.0 113.51 -171.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 84.0 p -67.38 -12.85 61.25 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.426 1.49 . . . . 0.0 114.119 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.9 25.81 14.98 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.406 1.883 . . . . 0.0 113.2 -175.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -144.18 164.42 29.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 125.419 1.488 . . . . 0.0 110.299 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -64.84 141.22 70.57 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 CA-C-N 120.057 1.056 . . . . 0.0 111.951 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -89.21 -25.83 21.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.931 0.892 . . . . 0.0 110.96 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.5 t -123.98 134.91 65.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.691 1.996 . . . . 0.0 108.324 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.3 t -132.82 145.48 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.972 0.909 . . . . 0.0 111.36 -171.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.0 120.13 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.377 2.671 . . . . 0.0 108.422 -169.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.2 mt -85.54 164.21 17.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.253 1.025 . . . . 0.0 112.058 177.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.02 -13.79 13.22 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -175.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -120.32 9.79 11.1 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.48 1.512 . . . . 0.0 113.354 -177.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.96 9.02 58.71 Favored Glycine 0 CA--C 1.533 1.212 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 174.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.13 136.49 41.09 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.815 1.307 . . . . 0.0 108.438 169.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.21 142.59 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.915 1.286 . . . . 0.0 109.169 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.6 p -54.02 127.31 54.04 Favored Pre-proline 0 N--CA 1.472 0.655 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.232 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.34 122.78 8.98 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.535 2.157 . . . . 0.0 111.423 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.524 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 3.3 p90 -159.03 -179.27 7.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.925 2.09 . . . . 0.0 110.594 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -140.85 99.39 3.6 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 172.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.4 tp -57.73 127.93 34.53 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.369 2.268 . . . . 0.0 109.418 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -125.58 150.53 47.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.059 1.344 . . . . 0.0 110.546 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.3 mtt -133.06 144.74 50.21 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.42 -176.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.61 147.62 43.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.32 1.448 . . . . 0.0 111.317 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -65.86 121.43 15.03 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.982 0.913 . . . . 0.0 110.506 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.62 -18.91 64.41 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 176.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -72.07 -65.51 2.35 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.611 1.1 . . . . 0.0 113.166 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 38.5 p -83.83 -26.1 29.8 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 83.87 -0.1 89.59 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.142 1.353 . . . . 0.0 113.874 -170.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -80.09 145.91 61.91 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-N 118.705 1.253 . . . . 0.0 112.403 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.39 151.24 80.63 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.932 2.421 . . . . 0.0 112.007 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.61 -47.47 1.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.827 1.651 . . . . 0.0 112.619 -169.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 8.0 tp -151.94 156.2 39.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.951 1.3 . . . . 0.0 109.813 -169.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -146.69 139.31 25.11 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.384 1.074 . . . . 0.0 109.149 174.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.0 131.65 56.88 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.134 1.774 . . . . 0.0 108.285 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.9 t -118.95 139.83 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.456 1.502 . . . . 0.0 111.214 -169.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.524 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.7 t -123.21 144.59 49.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.031 1.732 . . . . 0.0 111.255 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.0 m -129.42 8.77 5.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.724 1.21 . . . . 0.0 113.712 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.89 -12.8 4.47 Favored Glycine 0 CA--C 1.537 1.424 0 N-CA-C 115.71 1.044 . . . . 0.0 115.71 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 87.7 p -157.78 159.71 37.05 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.057 1.428 . . . . 0.0 114.128 -173.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 35.0 t-105 -60.67 139.9 92.93 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 127.068 2.147 . . . . 0.0 115.803 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -95.9 179.01 8.47 Favored 'Cis proline' 0 CA--C 1.547 1.168 0 CA-C-N 120.05 1.053 . . . . 0.0 110.828 -11.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -72.3 165.35 24.65 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.15 -0.969 . . . . 0.0 112.251 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -118.71 129.49 55.31 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.891 1.676 . . . . 0.0 111.58 -176.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -92.61 143.96 25.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.375 1.87 . . . . 0.0 112.582 -169.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.3 t -150.39 159.34 44.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.195 1.798 . . . . 0.0 110.924 171.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -78.85 134.45 36.94 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.366 -0.834 . . . . 0.0 109.014 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.18 60.13 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.939 2.096 . . . . 0.0 115.589 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 39.4 ptt180 44.68 27.29 0.24 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.874 2.87 . . . . 0.0 117.405 -176.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -57.94 -30.42 65.95 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 40.7 p -79.87 -15.24 57.75 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 174.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -72.01 -39.3 6.65 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo . . . . . 0 C--O 1.25 1.103 0 C-N-CA 124.297 3.331 . . . . 0.0 115.222 176.047 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.1 tpp . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 120.296 0.093 . . . . 0.0 110.79 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -131.09 18.66 4.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.138 1.375 . . . . 0.0 113.741 -173.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -137.0 155.05 50.2 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.583 1.553 . . . . 0.0 111.827 -175.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.96 44.04 0.22 Allowed Glycine 0 CA--C 1.535 1.317 0 C-N-CA 124.343 0.973 . . . . 0.0 113.495 -172.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 28.0 ttp-105 -129.46 22.82 5.52 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.272 1.829 . . . . 0.0 112.102 -172.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -60.83 -20.85 62.45 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.448 1.499 . . . . 0.0 114.861 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -66.11 -41.9 89.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.044 0.937 . . . . 0.0 112.432 171.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.02 -46.83 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 118.381 -0.819 . . . . 0.0 109.409 170.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.91 90.71 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.559 1.072 . . . . 0.0 113.028 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -61.82 -48.72 79.33 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.436 1.016 . . . . 0.0 111.818 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 m -57.66 -47.62 81.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.905 0.482 . . . . 0.0 111.12 176.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.72 -34.25 77.42 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.109 1.764 . . . . 0.0 112.424 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.41 ' HA ' HD11 ' A' ' 80' ' ' LEU . . . -61.82 -46.51 89.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.62 1.1 . . . . 0.0 111.534 169.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.61 -37.47 86.71 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.248 1.019 . . . . 0.0 111.663 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -65.44 -46.57 79.37 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.056 0.942 . . . . 0.0 112.238 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 84.8 m -60.34 -35.06 74.78 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.326 1.05 . . . . 0.0 111.803 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.55 73.4 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.025 1.33 . . . . 0.0 113.48 174.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -44.05 97.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.6 -0.687 . . . . 0.0 111.518 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -59.79 -48.54 81.28 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.6 1.16 . . . . 0.0 111.854 173.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -58.39 -44.6 89.0 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.134 0.879 . . . . 0.0 112.183 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 29.8 m -61.25 -43.03 99.55 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.493 0.588 . . . . 0.0 110.797 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.45 93.67 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.073 -1.017 . . . . 0.0 113.429 172.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.62 76.33 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.123 0.969 . . . . 0.0 112.779 175.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.3 tp -72.94 -34.64 66.69 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.756 1.223 . . . . 0.0 111.537 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.33 -45.33 93.72 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.049 -1.032 . . . . 0.0 110.833 169.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.33 -45.78 55.13 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.869 1.668 . . . . 0.0 111.178 169.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.51 96.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.91 -48.67 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.836 0.744 . . . . 0.0 110.427 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.25 -29.15 69.66 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.572 1.149 . . . . 0.0 113.167 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -87.01 -37.53 17.41 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.068 0.947 . . . . 0.0 113.082 177.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.22 -33.23 71.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.306 1.042 . . . . 0.0 113.623 -177.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 t -74.17 -13.87 60.87 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.6 mt -110.26 -35.96 5.94 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 113.536 -173.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.3 p -70.24 -35.24 73.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.908 1.283 . . . . 0.0 113.703 -177.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.26 0.8 50.84 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.406 1.479 . . . . 0.0 114.699 -175.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -144.67 147.6 36.48 Favored Pre-proline 0 N--CA 1.473 0.68 0 C-N-CA 125.243 1.417 . . . . 0.0 110.08 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -46.78 152.71 1.57 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 122.608 2.205 . . . . 0.0 112.116 167.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.23 160.65 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.417 1.487 . . . . 0.0 108.455 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.66 175.97 28.57 Favored Glycine 0 CA--C 1.522 0.482 0 O-C-N 120.886 -1.134 . . . . 0.0 114.53 -176.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.4 mt -135.72 127.65 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.603 1.161 . . . . 0.0 108.728 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -99.95 130.66 46.15 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.272 1.829 . . . . 0.0 109.587 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -118.61 121.71 40.85 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.055 1.742 . . . . 0.0 107.919 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 p -115.34 -178.47 3.38 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.567 1.147 . . . . 0.0 113.112 -169.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -65.54 -13.54 59.15 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.2 m -139.1 -21.34 0.95 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -170.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -156.65 -172.71 4.17 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.844 1.258 . . . . 0.0 111.495 -178.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p90 -147.64 149.21 32.07 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.3 -0.875 . . . . 0.0 110.28 169.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 67.1 mtt-85 -146.86 145.63 29.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.289 1.435 . . . . 0.0 111.9 -171.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 14.3 mm -73.57 146.65 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.0 mtp -135.86 146.23 47.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.355 1.062 . . . . 0.0 111.483 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.9 m -140.14 165.49 30.21 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.703 1.601 . . . . 0.0 112.358 -169.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -59.79 -31.56 94.17 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.272 2.648 . . . . 0.0 114.642 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 45.33 -83.53 0.01 OUTLIER Glycine 0 CA--C 1.536 1.393 0 C-N-CA 127.719 2.58 . . . . 0.0 116.082 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -62.33 -39.56 93.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.955 1.302 . . . . 0.0 113.196 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.1 t -161.32 136.7 5.7 Favored Pre-proline 0 N--CA 1.478 0.93 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.45 -12.35 3.86 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.75 2.966 . . . . 0.0 112.995 169.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 m -70.21 -16.19 63.03 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -169.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -149.75 165.18 33.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.736 2.014 . . . . 0.0 109.556 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.6 t-105 -49.95 115.64 1.48 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.748 1.219 . . . . 0.0 112.002 178.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -150.55 149.89 30.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.263 1.425 . . . . 0.0 110.404 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -142.18 137.9 31.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.727 0.811 . . . . 0.0 112.72 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.3 t -141.91 135.23 14.3 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 126.964 2.106 . . . . 0.0 108.224 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.86 137.61 45.69 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.868 2.378 . . . . 0.0 111.644 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.1 tp -96.47 127.16 42.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.284 0.634 . . . . 0.0 111.375 -172.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -159.96 -24.25 0.07 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 169.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.22 -18.2 46.84 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -172.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -126.78 16.61 7.45 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.634 1.574 . . . . 0.0 113.097 174.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -129.46 4.08 5.11 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.237 1.815 . . . . 0.0 113.225 176.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.55 -65.19 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 130.389 3.475 . . . . 0.0 116.552 -177.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -152.99 4.89 0.35 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.298 1.839 . . . . 0.0 113.106 -176.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.81 36.37 0.21 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.016 1.726 . . . . 0.0 113.38 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.8 t -140.35 -157.1 0.74 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.049 2.54 . . . . 0.0 108.839 -173.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 43.78 43.81 5.24 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 171.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 56.78 21.81 6.35 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -176.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.09 -16.35 51.66 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 118.931 -2.356 . . . . 0.0 113.918 172.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.5 m0 -66.05 -18.82 65.59 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -170.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -140.44 170.7 15.31 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -172.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.77 15.7 2.32 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.485 1.514 . . . . 0.0 113.392 175.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -146.27 -0.91 0.75 Allowed 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 115.274 1.583 . . . . 0.0 115.274 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 13' ' ' ALA . 27.9 mt -120.58 162.63 19.31 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -168.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.6 t -139.13 131.24 28.03 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 128.442 2.697 . . . . 0.0 106.359 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -106.97 147.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 123.644 0.778 . . . . 0.0 111.183 -169.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -133.38 156.69 47.21 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.513 1.925 . . . . 0.0 109.549 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.12 162.88 31.7 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.06 0.944 . . . . 0.0 111.909 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.52 142.09 11.03 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.897 1.679 . . . . 0.0 110.002 169.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -72.59 -7.76 16.29 Favored 'Cis proline' 0 CA--C 1.546 1.083 0 CA-C-N 120.737 1.299 . . . . 0.0 113.32 -9.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -65.18 175.29 1.68 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.229 1.412 . . . . 0.0 112.073 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.58 142.28 19.0 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.254 1.022 . . . . 0.0 113.027 -174.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.33 91.71 1.11 Allowed 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 124.1 3.2 . . . . 0.0 110.826 177.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -157.38 138.45 13.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 0.0 110.272 -170.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -60.89 86.76 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.408 1.083 . . . . 0.0 112.006 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.7 m -95.69 -2.16 48.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.782 1.633 . . . . 0.0 113.161 -169.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.43 18.39 3.45 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 126.877 2.071 . . . . 0.0 114.449 -177.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -158.43 162.43 26.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 126.876 2.07 . . . . 0.0 109.348 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.28 152.4 75.82 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 CA-C-N 120.178 1.099 . . . . 0.0 110.441 169.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -102.85 -44.58 5.23 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.479 0.312 . . . . 0.0 110.289 170.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.0 t -74.85 132.8 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.864 0.866 . . . . 0.0 109.183 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.2 t -134.37 144.81 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.814 0.846 . . . . 0.0 110.796 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.4 mp -130.45 122.31 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 127.749 2.42 . . . . 0.0 109.46 -169.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.2 mt -87.92 159.75 18.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.997 0.904 . . . . 0.0 111.623 174.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.05 -27.57 63.71 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.127 1.371 . . . . 0.0 114.509 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -84.74 -5.18 59.31 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.088 1.355 . . . . 0.0 113.431 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.39 12.14 61.7 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.217 0.913 . . . . 0.0 114.61 -176.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -76.89 136.38 38.84 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 118.482 1.141 . . . . 0.0 108.734 169.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -130.01 148.32 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.054 1.341 . . . . 0.0 109.431 -172.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 p -51.49 124.06 24.01 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.047 0.939 . . . . 0.0 111.908 169.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -74.03 92.69 0.89 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.151 2.567 . . . . 0.0 111.6 177.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -134.34 -178.09 4.89 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.258 1.823 . . . . 0.0 112.093 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 m -141.68 147.63 37.79 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.665 0.786 . . . . 0.0 111.259 169.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.5 133.01 52.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.993 2.117 . . . . 0.0 108.438 -176.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -122.14 147.19 46.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.119 -176.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 52.3 mtt -123.85 129.5 51.11 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.983 1.313 . . . . 0.0 109.761 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.9 143.6 51.23 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.896 1.678 . . . . 0.0 111.061 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -53.49 124.18 14.15 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.525 1.13 . . . . 0.0 111.566 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.54 -20.6 56.75 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -112.07 -48.62 0.65 Allowed Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.773 1.177 . . . . 0.0 113.214 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.8 m -71.87 -22.02 61.58 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.13 0.965 . . . . 0.0 112.288 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 68.14 35.86 84.26 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.235 0.921 . . . . 0.0 113.49 177.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -133.06 132.72 22.48 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.422 1.489 . . . . 0.0 110.887 -169.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -53.11 145.06 44.32 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 124.051 3.167 . . . . 0.0 115.0 177.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -34.08 4.09 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.736 1.215 . . . . 0.0 111.44 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -154.4 157.58 38.74 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 111.997 -168.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 7.4 m -143.94 147.8 34.46 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.301 1.84 . . . . 0.0 109.403 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.6 mp -119.42 142.17 48.45 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 126.161 1.785 . . . . 0.0 108.784 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 40.0 t -135.11 134.4 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.665 0.786 . . . . 0.0 111.702 -169.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -108.86 161.29 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.958 1.303 . . . . 0.0 112.137 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.5 p -133.78 2.07 3.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.885 1.674 . . . . 0.0 113.766 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 121.56 -8.82 10.1 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.121 1.343 . . . . 0.0 114.503 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.4 p -155.65 159.38 39.54 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 118.59 1.195 . . . . 0.0 113.75 -174.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.8 t-105 -60.9 138.73 93.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.852 2.061 . . . . 0.0 115.732 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.6 175.55 10.3 Favored 'Cis proline' 0 CA--C 1.546 1.11 0 CA-C-N 119.926 1.009 . . . . 0.0 110.717 -11.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.0 154.31 42.11 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 122.203 1.001 . . . . 0.0 110.718 169.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -79.05 168.11 20.12 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.311 1.445 . . . . 0.0 109.047 169.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -144.42 130.63 19.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.546 1.538 . . . . 0.0 109.968 -177.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.3 t -151.83 160.83 43.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.956 1.302 . . . . 0.0 112.173 -171.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.33 131.09 35.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.412 -0.805 . . . . 0.0 109.142 169.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.27 61.08 0.55 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.203 1.801 . . . . 0.0 115.541 173.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 57.29 12.37 1.37 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.997 2.519 . . . . 0.0 117.291 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -55.63 -35.05 65.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.575 2.065 . . . . 0.0 116.575 -169.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -80.59 -15.64 56.13 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -66.65 133.93 94.23 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.075 0.95 . . . . 0.0 112.182 -169.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 C--O 1.249 1.062 0 C-N-CA 123.446 2.764 . . . . 0.0 113.17 178.334 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.76 146.1 32.88 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.431 1.092 . . . . 0.0 111.063 171.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -68.88 -18.75 64.18 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -150.74 155.2 26.04 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 126.524 2.012 . . . . 0.0 109.974 170.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 66.5 mtt85 -71.22 81.11 0.72 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.624 1.57 . . . . 0.0 113.013 -169.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -52.57 -34.28 49.7 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -173.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -72.82 -38.36 67.18 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.985 -1.072 . . . . 0.0 113.033 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.83 -38.9 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.94 170.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.73 -44.03 97.27 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.317 0.962 . . . . 0.0 112.422 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -57.75 -46.33 84.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.085 1.311 . . . . 0.0 111.843 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.8 m -61.41 -57.11 13.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.615 0.766 . . . . 0.0 111.255 178.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -63.11 -34.39 77.51 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.145 1.378 . . . . 0.0 113.076 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.65 -52.76 63.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.692 1.587 . . . . 0.0 111.719 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -64.22 -41.87 96.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.93 -54.25 44.49 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.307 1.443 . . . . 0.0 112.417 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.3 m -60.6 -36.43 78.55 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.892 1.277 . . . . 0.0 111.414 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.91 86.9 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.5 99.29 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.433 -0.792 . . . . 0.0 111.915 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -61.39 -46.32 90.67 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 111.858 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -62.73 -41.42 99.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.473 0.709 . . . . 0.0 112.107 173.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.1 m -59.38 -41.55 89.59 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.1 0.863 . . . . 0.0 111.322 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -40.65 96.05 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.77 -1.206 . . . . 0.0 113.399 172.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.68 -30.98 71.75 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 121.144 -0.972 . . . . 0.0 113.234 174.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.0 tp -72.1 -34.52 68.7 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.39 1.076 . . . . 0.0 111.84 172.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.18 -46.11 90.39 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.058 -1.026 . . . . 0.0 111.467 169.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.9 tp -53.98 -46.83 71.81 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.082 1.353 . . . . 0.0 111.982 170.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.45 -43.67 88.92 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 175.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.33 -46.62 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.805 0.842 . . . . 0.0 110.981 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -31.28 69.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.924 0.89 . . . . 0.0 112.931 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.9 mtt-85 -80.28 -37.98 31.73 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.24 1.016 . . . . 0.0 113.483 172.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.93 -34.47 78.18 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.524 1.056 . . . . 0.0 113.369 -175.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.1 t -70.29 -20.18 63.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.94 -31.25 9.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.199 1.4 . . . . 0.0 114.336 -174.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.7 m -82.13 -14.19 56.09 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.81 -3.94 81.51 Favored Glycine 0 CA--C 1.54 1.632 0 C-N-CA 124.22 0.914 . . . . 0.0 115.069 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -139.99 151.84 66.21 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 128.399 2.68 . . . . 0.0 106.765 170.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -45.63 166.65 0.06 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.358 3.372 . . . . 0.0 115.871 169.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -123.22 161.22 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 126.283 1.833 . . . . 0.0 108.235 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -165.28 -175.56 36.04 Favored Glycine 0 N--CA 1.469 0.889 0 CA-C-N 120.698 1.59 . . . . 0.0 115.964 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -127.41 122.54 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.783 1.233 . . . . 0.0 110.886 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -83.4 68.88 9.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.346 1.858 . . . . 0.0 111.322 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -59.65 119.95 8.56 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.466 -0.771 . . . . 0.0 110.219 169.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 84.1 p -141.33 13.52 2.18 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -169.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.76 -47.28 0.26 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.693 2.797 . . . . 0.0 115.169 -174.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.7 m -69.27 -26.95 65.01 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.63 1.172 . . . . 0.0 112.611 171.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.47 166.63 31.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.425 1.89 . . . . 0.0 111.043 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -155.96 99.39 1.97 Allowed 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.915 -0.491 . . . . 0.0 111.558 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -142.42 161.69 37.39 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -169.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.1 mm -71.47 142.52 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.528 1.131 . . . . 0.0 111.213 -171.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 81.0 mtp -128.4 146.67 50.72 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.796 1.638 . . . . 0.0 110.17 169.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 m -133.7 158.86 74.52 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 125.922 1.689 . . . . 0.0 111.26 -170.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -52.39 144.84 38.66 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.417 2.745 . . . . 0.0 115.503 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -101.62 -151.24 24.31 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 125.513 1.53 . . . . 0.0 113.087 175.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -55.42 -23.7 26.36 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.2 p -133.27 65.5 72.93 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 119.44 1.018 . . . . 0.0 113.204 -169.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -63.09 -17.19 58.93 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 123.04 2.493 . . . . 0.0 113.272 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -59.59 -15.36 18.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.427 1.491 . . . . 0.0 114.008 169.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.85 -87.39 0.2 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.62 1.168 . . . . 0.0 111.947 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -162.88 110.08 1.23 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.435 1.094 . . . . 0.0 111.874 -171.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.58 151.29 29.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.211 1.004 . . . . 0.0 110.11 169.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -138.69 150.5 46.26 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -171.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.8 t -143.4 138.96 15.96 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 126.957 2.103 . . . . 0.0 108.686 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.93 145.82 90.63 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.592 2.194 . . . . 0.0 111.304 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.42 45.46 0.23 Allowed 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -170.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -58.01 -20.76 41.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 119.635 -1.915 . . . . 0.0 113.841 172.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -59.42 -18.84 42.56 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.245 1.018 . . . . 0.0 113.686 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -130.69 -35.27 1.47 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.2 1.0 . . . . 0.0 113.498 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.13 -8.19 59.29 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 177.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.14 -60.29 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 129.436 3.095 . . . . 0.0 116.158 -173.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -148.03 -0.55 0.6 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.431 1.892 . . . . 0.0 112.898 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -92.23 0.49 57.46 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.674 -1.266 . . . . 0.0 113.415 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.2 p -64.57 13.89 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 128.456 2.702 . . . . 0.0 117.28 -172.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -154.44 42.82 0.51 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.557 1.543 . . . . 0.0 111.717 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -136.59 163.2 31.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.562 1.545 . . . . 0.0 112.878 -173.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -72.7 -177.42 2.3 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.782 0.833 . . . . 0.0 110.78 168.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -120.45 -6.83 9.77 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -150.64 -168.66 3.17 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -168.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -125.22 2.67 7.85 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.458 1.903 . . . . 0.0 114.382 -175.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -150.12 -4.33 0.36 Allowed 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -169.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.4 mt -105.84 167.91 9.47 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.707 -1.246 . . . . 0.0 113.139 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.7 t -140.76 136.59 32.68 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.427 2.291 . . . . 0.0 107.83 169.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.72 145.36 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.47 1.108 . . . . 0.0 111.272 -169.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -137.76 157.56 46.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.239 1.816 . . . . 0.0 110.142 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.508 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.8 tt -151.22 146.01 25.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.9 0.88 . . . . 0.0 112.089 -171.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.508 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.2 pm0 -151.69 150.88 27.44 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.579 1.552 . . . . 0.0 111.125 169.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -80.04 -13.12 35.62 Favored 'Cis proline' 0 CA--C 1.543 0.943 0 CA-C-N 120.198 1.107 . . . . 0.0 114.451 -0.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -64.19 144.23 57.29 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.948 0.88 . . . . 0.0 113.234 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -62.49 128.87 92.08 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.539 1.536 . . . . 0.0 112.008 170.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.59 57.58 6.15 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 123.768 2.979 . . . . 0.0 109.673 169.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.39 150.0 26.45 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.039 1.336 . . . . 0.0 113.369 -169.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -74.17 47.98 0.3 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.859 1.664 . . . . 0.0 112.579 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.1 m -67.96 -5.59 17.9 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.942 1.697 . . . . 0.0 115.383 -172.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 56.31 27.83 12.47 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 126.157 1.783 . . . . 0.0 113.516 -174.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -146.9 163.12 30.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 109.3 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.75 147.54 85.79 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 CA-C-N 120.085 1.066 . . . . 0.0 111.867 169.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -95.3 -50.47 5.01 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.686 1.194 . . . . 0.0 109.806 170.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 68.3 t -89.66 136.4 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.371 1.468 . . . . 0.0 108.15 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 48.8 t -135.16 143.57 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-O 122.147 0.975 . . . . 0.0 111.947 -171.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -117.19 111.03 33.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 128.582 2.753 . . . . 0.0 107.639 -176.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.15 153.07 36.48 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.134 0.973 . . . . 0.0 109.81 177.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.82 -21.93 44.94 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.28 -11.4 59.9 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.275 1.43 . . . . 0.0 113.573 176.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.48 42.67 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.499 1.047 . . . . 0.0 114.187 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.69 147.44 29.58 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.981 1.312 . . . . 0.0 108.103 173.668 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -121.97 150.88 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.693 0.797 . . . . 0.0 110.585 -168.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.3 p -56.78 130.52 78.18 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.693 169.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -74.97 134.08 17.42 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.34 2.027 . . . . 0.0 112.201 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.461 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 14.5 p90 -163.92 177.28 8.68 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.693 1.997 . . . . 0.0 111.346 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.4 p -138.54 148.49 44.31 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.015 0.912 . . . . 0.0 110.646 169.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 tp -135.81 130.19 33.6 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.835 2.054 . . . . 0.0 108.089 -169.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -121.2 150.25 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.007 1.323 . . . . 0.0 110.363 -173.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 55.3 mtt -127.53 139.66 52.63 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 125.561 1.545 . . . . 0.0 108.669 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -136.83 151.39 49.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.293 1.437 . . . . 0.0 111.11 -177.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -61.73 119.8 9.41 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.365 1.066 . . . . 0.0 109.685 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.1 -19.4 61.42 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -174.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -101.66 -45.02 1.86 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 124.073 0.844 . . . . 0.0 113.609 -177.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.6 p -80.29 -27.82 38.42 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.707 1.254 . . . . 0.0 112.858 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 79.75 0.86 85.99 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 125.119 1.342 . . . . 0.0 113.928 -172.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -75.9 138.42 69.45 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 118.564 1.182 . . . . 0.0 111.638 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.25 154.59 72.86 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.566 2.177 . . . . 0.0 111.798 175.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.25 -51.32 1.19 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.983 1.713 . . . . 0.0 112.06 -169.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.82 153.12 40.55 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 126.847 2.059 . . . . 0.0 108.426 -169.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 4.9 m -143.97 136.84 27.28 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.539 0.736 . . . . 0.0 109.506 172.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.1 mp -116.55 143.78 45.18 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.819 2.448 . . . . 0.0 108.096 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 24.0 t -141.44 134.1 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.901 0.48 . . . . 0.0 111.911 -171.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.461 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.7 t -112.72 114.64 27.31 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.943 1.697 . . . . 0.0 110.305 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.4 p -75.34 -13.2 60.4 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.935 1.294 . . . . 0.0 114.296 174.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 128.21 0.62 6.36 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.414 1.483 . . . . 0.0 114.339 -175.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 19.5 m -156.56 156.06 32.97 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.428 -1.631 . . . . 0.0 112.996 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 30.3 t-105 -60.09 140.15 90.87 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 125.939 1.696 . . . . 0.0 115.344 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -94.29 176.55 12.33 Favored 'Cis proline' 0 CA--C 1.546 1.089 0 CA-C-N 119.932 1.011 . . . . 0.0 110.751 -11.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.1 mp -67.87 149.52 49.73 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.069 -1.019 . . . . 0.0 110.746 169.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -77.87 170.7 16.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.982 1.313 . . . . 0.0 110.282 170.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -140.01 144.45 36.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.781 1.632 . . . . 0.0 111.394 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.7 t -153.42 151.55 30.02 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.889 1.275 . . . . 0.0 111.7 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.88 134.22 50.48 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.588 -0.695 . . . . 0.0 109.841 170.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.68 67.87 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 127.423 2.289 . . . . 0.0 116.579 171.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.3 mtm105 55.7 19.65 3.51 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.27 -17.52 12.24 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -177.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 8.3 t -134.09 28.34 3.8 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.022 1.329 . . . . 0.0 113.334 169.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.66 71.23 71.03 Favored Pre-proline 0 N--CA 1.481 1.12 0 C-N-CA 125.282 1.433 . . . . 0.0 110.677 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo . . . . . 0 C--O 1.251 1.167 1 C-N-CA 125.507 4.138 . . . . 0.0 116.048 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.487 1.418 0 N-CA-C 110.669 -0.122 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.51 161.68 39.19 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.754 1.222 . . . . 0.0 112.091 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -61.57 -25.4 67.3 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.013 1.725 . . . . 0.0 114.687 -172.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -171.71 162.97 35.46 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.416 1.484 . . . . 0.0 111.89 174.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 52.59 19.07 1.11 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 126.005 1.722 . . . . 0.0 114.734 -175.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -56.36 -38.51 71.5 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -169.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.58 -40.13 80.66 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.107 0.867 . . . . 0.0 112.316 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.46 -46.4 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.253 0.621 . . . . 0.0 109.957 174.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.22 87.38 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.731 0.696 . . . . 0.0 112.37 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -63.63 -46.42 85.76 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.204 0.911 . . . . 0.0 112.219 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.6 m -56.72 -49.77 74.19 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.932 175.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -67.47 -28.57 67.97 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.001 -1.0 . . . . 0.0 113.615 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.52 -48.09 78.99 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 120.711 1.596 . . . . 0.0 111.37 171.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -67.74 -40.64 84.14 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.829 1.252 . . . . 0.0 111.431 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.75 -38.65 80.28 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.697 0.799 . . . . 0.0 113.038 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.5 m -69.71 -34.44 73.9 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 120.117 -1.614 . . . . 0.0 111.853 175.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.65 91.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 170.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.29 92.94 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 112.06 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -64.49 -45.08 88.84 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.016 0.926 . . . . 0.0 112.328 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -62.76 -40.35 97.0 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.195 0.598 . . . . 0.0 112.342 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -60.86 -44.08 97.49 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.796 0.726 . . . . 0.0 110.795 175.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.75 98.29 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.686 -1.259 . . . . 0.0 113.391 172.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.49 76.15 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.14 -0.975 . . . . 0.0 113.097 175.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.1 tp -73.13 -31.74 64.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.439 1.095 . . . . 0.0 111.818 173.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -62.97 -44.31 96.39 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.935 -1.103 . . . . 0.0 110.864 169.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.15 -44.64 67.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.376 1.47 . . . . 0.0 111.321 169.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.28 97.15 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.2 mt -64.14 -45.0 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.202 1.001 . . . . 0.0 111.099 174.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.43 -43.52 75.44 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.803 0.841 . . . . 0.0 112.1 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.73 -31.77 61.92 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 178.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.8 89.7 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.414 1.007 . . . . 0.0 113.191 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -76.08 -24.26 55.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.12 -31.11 13.7 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -174.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.2 p -89.5 -14.52 35.07 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -169.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.23 6.53 78.27 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 170.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.62 151.71 54.51 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.987 2.115 . . . . 0.0 107.596 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -46.88 149.31 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 121.98 1.787 . . . . 0.0 111.652 167.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.19 164.93 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.323 1.849 . . . . 0.0 108.486 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.29 -178.68 30.68 Favored Glycine 0 C--N 1.332 0.308 0 O-C-N 120.762 -1.211 . . . . 0.0 115.404 -174.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.6 mt -135.6 120.88 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.564 1.146 . . . . 0.0 108.543 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -89.97 141.89 28.23 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 126.156 1.783 . . . . 0.0 110.861 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -140.07 130.23 25.06 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.137 1.775 . . . . 0.0 109.449 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 t -132.55 179.66 6.0 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.233 1.413 . . . . 0.0 111.039 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -61.85 -14.95 38.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -169.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 -8.42 0.92 Allowed 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 -178.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.5 164.52 36.08 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.778 1.172 . . . . 0.0 113.248 -177.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -149.67 156.22 41.52 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.269 1.828 . . . . 0.0 112.006 -175.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -161.26 148.0 14.73 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.727 1.611 . . . . 0.0 111.342 -175.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.9 mm -68.23 147.68 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 124.411 1.085 . . . . 0.0 109.566 172.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 44.7 mtp -135.75 150.67 49.58 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.474 -1.391 . . . . 0.0 112.466 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 9.4 m -144.06 168.03 13.67 Favored Pre-proline 0 N--CA 1.478 0.969 0 C-N-CA 126.219 1.808 . . . . 0.0 111.736 -169.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -57.53 -33.74 96.95 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.821 2.347 . . . . 0.0 114.089 171.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.46 -50.27 0.61 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 127.47 2.462 . . . . 0.0 116.673 170.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -137.72 -26.52 0.96 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.342 1.457 . . . . 0.0 114.578 -170.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.0 t -148.84 74.94 10.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 123.8 0.84 . . . . 0.0 112.646 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -63.35 -11.5 25.92 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.996 2.464 . . . . 0.0 113.624 170.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.2 m -60.08 -16.89 35.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.538 1.935 . . . . 0.0 114.662 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.01 171.01 15.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.133 1.773 . . . . 0.0 110.472 175.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.3 t-105 -62.8 112.39 2.52 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.366 -0.834 . . . . 0.0 111.145 173.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.457 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 4.6 tpm_? -150.65 157.29 42.8 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.852 1.261 . . . . 0.0 110.98 174.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.457 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 85.4 m95 -139.19 138.46 36.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.207 1.403 . . . . 0.0 111.945 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.77 138.86 17.57 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 126.966 2.106 . . . . 0.0 107.795 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.08 128.74 22.49 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.84 2.36 . . . . 0.0 111.183 175.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.3 tp -76.17 78.8 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.366 1.066 . . . . 0.0 111.133 -176.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -91.3 5.46 49.12 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.32 1.048 . . . . 0.0 112.24 171.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -50.11 110.54 0.41 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.728 2.011 . . . . 0.0 111.966 173.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.0 t70 57.95 -29.71 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.533 2.733 . . . . 0.0 116.385 -171.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 72' ' ' SER . . . -68.38 -18.29 64.43 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.346 1.859 . . . . 0.0 113.644 175.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.73 -178.01 0.14 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.329 2.652 . . . . 0.0 115.653 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -72.8 23.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.967 1.707 . . . . 0.0 114.619 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.31 7.18 5.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.896 2.078 . . . . 0.0 111.216 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.401 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 73.3 p -79.83 -23.53 41.96 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.357 1.463 . . . . 0.0 114.084 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -74.08 123.19 23.93 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.248 1.019 . . . . 0.0 109.207 169.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -147.43 -179.48 6.88 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.098 0.959 . . . . 0.0 112.801 -169.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.91 25.51 10.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.05 2.14 . . . . 0.0 112.579 -177.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER 58.17 -44.66 0.05 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 130.131 3.372 . . . . 0.0 118.413 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -156.55 -167.91 2.54 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.334 0.97 . . . . 0.0 113.409 -169.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -128.09 -14.14 4.97 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.785 2.034 . . . . 0.0 113.121 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -120.42 5.03 10.69 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.59 1.556 . . . . 0.0 111.904 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -139.26 141.63 37.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.531 1.532 . . . . 0.0 110.064 -169.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 88.9 p -137.14 154.91 50.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.678 1.991 . . . . 0.0 111.39 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.07 147.6 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.107 1.363 . . . . 0.0 112.173 -169.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -139.68 162.28 35.49 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.898 2.079 . . . . 0.0 110.838 170.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.2 mt -141.14 155.95 46.02 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.592 1.157 . . . . 0.0 113.932 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.69 155.14 22.18 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.893 2.077 . . . . 0.0 110.325 169.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.13 -9.16 18.38 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 CA-C-N 120.469 1.203 . . . . 0.0 113.207 -9.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.16 172.01 1.59 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.613 1.565 . . . . 0.0 113.361 173.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -126.31 121.66 23.81 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.368 1.867 . . . . 0.0 110.932 -170.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.5 98.3 0.94 Allowed 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.698 2.265 . . . . 0.0 110.475 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -154.35 157.23 38.27 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.483 1.513 . . . . 0.0 111.301 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -70.52 47.0 0.09 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 128.219 2.608 . . . . 0.0 114.358 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.6 t -65.05 160.96 19.8 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.101 2.16 . . . . 0.0 114.303 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -63.81 -13.79 47.4 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.628 1.571 . . . . 0.0 112.727 169.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -131.04 162.78 53.52 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.271 1.428 . . . . 0.0 112.571 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -70.81 164.56 35.13 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.179 2.586 . . . . 0.0 112.416 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -95.57 -21.94 17.94 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.619 1.568 . . . . 0.0 112.398 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.1 t -114.11 143.26 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.547 1.139 . . . . 0.0 108.875 169.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.2 t -136.18 137.75 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 110.326 -178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -125.25 117.97 51.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 128.679 2.791 . . . . 0.0 106.925 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.15 148.58 35.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.385 0.612 . . . . 0.0 110.224 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.9 -22.79 60.16 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -70.02 -22.82 63.07 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.08 1.752 . . . . 0.0 113.458 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 104.09 5.13 44.17 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.98 1.276 . . . . 0.0 115.056 -179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.554 ' C ' HD12 ' A' ' 105' ' ' ILE . 9.1 pt20 -90.55 154.53 19.54 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.81 1.644 . . . . 0.0 109.869 169.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.554 HD12 ' C ' ' A' ' 104' ' ' GLN . 1.2 mp -129.76 142.7 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 124.696 1.198 . . . . 0.0 109.605 -169.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t -56.17 140.43 70.98 Favored Pre-proline 0 N--CA 1.477 0.875 0 C-N-CA 123.541 0.736 . . . . 0.0 112.642 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -64.73 131.18 28.45 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.765 2.31 . . . . 0.0 112.601 169.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.435 ' CZ ' HD21 ' A' ' 132' ' ' LEU . 26.1 p90 -161.52 173.57 14.63 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.785 1.634 . . . . 0.0 111.364 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.3 t -134.28 135.55 42.94 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.07 0.948 . . . . 0.0 110.194 169.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.1 tp -128.64 116.0 18.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 128.06 2.544 . . . . 0.0 108.467 -169.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -105.35 147.06 28.58 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.752 1.221 . . . . 0.0 110.444 -173.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 51.1 mtt -128.38 130.56 47.86 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.849 1.66 . . . . 0.0 109.753 -176.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -134.26 152.29 51.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.773 1.229 . . . . 0.0 112.29 -169.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -64.93 110.4 2.43 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.116 1.367 . . . . 0.0 110.528 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.56 -15.83 59.12 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.69 -20.49 59.75 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.721 1.153 . . . . 0.0 114.384 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -132.03 -21.28 2.4 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.987 1.393 . . . . 0.0 114.424 -171.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 86.78 -1.09 86.88 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 125.599 1.571 . . . . 0.0 114.4 -176.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -83.97 131.51 51.2 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.583 1.191 . . . . 0.0 112.517 -171.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 143.47 40.48 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.531 2.821 . . . . 0.0 113.568 169.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.11 -44.66 1.15 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.686 1.594 . . . . 0.0 112.151 -172.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 tt -149.94 155.21 39.58 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.833 1.653 . . . . 0.0 108.172 -178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 85.5 m -144.04 151.11 39.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.233 -1.542 . . . . 0.0 109.505 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 78.1 mt -128.11 133.59 49.03 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 127.295 2.238 . . . . 0.0 108.323 -169.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.5 t -133.58 135.92 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 122.982 0.513 . . . . 0.0 111.995 -169.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 34.0 t -119.41 141.0 49.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.945 1.698 . . . . 0.0 110.443 175.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -127.94 2.28 5.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.193 1.397 . . . . 0.0 113.833 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 152.59 -20.14 0.8 Allowed Glycine 0 CA--C 1.535 1.317 0 N-CA-C 115.852 1.101 . . . . 0.0 115.852 175.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 4.9 t -156.26 165.27 36.87 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.771 1.785 . . . . 0.0 114.345 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 -63.86 143.66 98.1 Favored Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 127.738 2.415 . . . . 0.0 115.333 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -91.44 177.26 15.84 Favored 'Cis proline' 0 CA--C 1.546 1.102 0 CA-C-N 119.479 0.85 . . . . 0.0 110.472 -11.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.435 HD21 ' CZ ' ' A' ' 108' ' ' PHE . 6.6 mp -68.3 156.26 38.07 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.061 -1.024 . . . . 0.0 111.66 169.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -101.98 129.02 48.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.445 1.498 . . . . 0.0 110.858 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -84.58 149.62 25.76 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.844 1.258 . . . . 0.0 112.048 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.0 t -149.77 146.17 27.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.028 1.731 . . . . 0.0 109.623 169.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.28 136.49 42.64 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.097 -1.002 . . . . 0.0 109.814 170.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 61.07 0.11 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.365 2.266 . . . . 0.0 115.427 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 11.6 ptm180 44.7 27.95 0.3 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.128 2.571 . . . . 0.0 117.763 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.76 -34.57 65.33 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.14 -4.1 58.56 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 174.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.37 48.67 0.51 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.25 1.42 . . . . 0.0 114.612 -170.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo . . . . . 0 C--O 1.249 1.058 0 C-N-CA 123.501 2.8 . . . . 0.0 113.173 179.555 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 ttp . . . . . 0 N--CA 1.489 1.485 0 N-CA-C 110.456 -0.202 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.3 170.69 17.94 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.085 1.354 . . . . 0.0 111.775 179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -127.89 5.79 6.02 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.125 1.77 . . . . 0.0 112.537 -175.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -148.15 157.19 27.24 Favored Glycine 0 CA--C 1.531 1.082 0 C-N-CA 127.785 2.612 . . . . 0.0 108.625 169.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -69.8 86.54 0.5 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.323 1.049 . . . . 0.0 113.701 -169.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -54.05 -26.19 25.4 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 171.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -76.92 -3.72 40.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.035 1.334 . . . . 0.0 114.425 175.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.3 t -129.54 -35.67 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 126.021 1.729 . . . . 0.0 111.696 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.64 73.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.719 1.208 . . . . 0.0 113.563 -173.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -60.01 -52.31 65.92 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.591 1.087 . . . . 0.0 111.919 174.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.9 m -60.08 -44.45 94.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.985 0.914 . . . . 0.0 111.386 177.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -33.92 76.11 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.268 1.027 . . . . 0.0 112.866 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.07 -48.78 78.7 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.872 1.215 . . . . 0.0 111.302 170.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -62.47 -38.34 89.47 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.523 1.129 . . . . 0.0 111.913 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.22 -50.34 68.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.09 1.356 . . . . 0.0 111.932 170.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.8 m -62.52 -32.94 73.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.549 1.14 . . . . 0.0 111.389 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.8 80.22 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.596 1.158 . . . . 0.0 113.292 170.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.3 95.29 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.462 -0.774 . . . . 0.0 111.736 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.99 -47.37 86.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.111 1.364 . . . . 0.0 112.058 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.59 -42.2 98.52 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.698 0.799 . . . . 0.0 112.458 171.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 59.6 m -59.29 -40.79 87.26 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.558 -0.714 . . . . 0.0 111.283 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.99 92.52 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.808 -1.183 . . . . 0.0 113.374 172.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.19 -33.73 76.45 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.202 -0.936 . . . . 0.0 112.915 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -70.37 -35.26 73.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.554 1.142 . . . . 0.0 112.147 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.62 -44.32 96.58 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.076 -1.015 . . . . 0.0 111.723 170.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.2 tp -54.11 -46.48 72.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.148 1.379 . . . . 0.0 111.534 170.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.02 96.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.3 mt -62.51 -46.53 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.261 0.937 . . . . 0.0 110.806 173.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.38 -36.59 78.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.463 0.705 . . . . 0.0 112.599 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -73.69 -30.67 63.02 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.04 0.936 . . . . 0.0 113.14 174.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.05 -39.77 90.41 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.971 1.259 . . . . 0.0 114.083 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -68.23 -29.04 67.77 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.675 -0.641 . . . . 0.0 112.121 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.1 mt -79.87 -33.77 39.75 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.025 1.33 . . . . 0.0 113.055 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.8 m -75.39 -22.57 57.36 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -173.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.89 9.79 71.37 Favored Glycine 0 CA--C 1.541 1.706 0 C-N-CA 123.74 0.686 . . . . 0.0 114.434 -176.441 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -151.15 150.64 27.79 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 128.402 2.681 . . . . 0.0 107.592 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -47.66 149.95 4.5 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.508 2.139 . . . . 0.0 112.741 168.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -116.17 165.31 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 126.913 2.085 . . . . 0.0 108.714 -175.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -150.59 175.42 29.62 Favored Glycine 0 CA--C 1.52 0.371 0 O-C-N 121.024 -1.047 . . . . 0.0 115.508 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.6 mt -132.67 120.1 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 124.858 1.263 . . . . 0.0 108.316 178.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -81.86 146.03 30.06 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.306 1.442 . . . . 0.0 110.771 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -142.35 138.3 31.13 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.461 1.905 . . . . 0.0 110.587 174.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.8 p -129.6 -177.61 4.34 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.661 1.584 . . . . 0.0 112.09 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.09 -15.6 14.87 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.1 p -142.61 -11.06 0.81 Allowed 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.466 2.025 . . . . 0.0 116.466 -172.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -150.73 172.13 16.06 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.117 1.326 . . . . 0.0 113.816 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -141.72 158.61 43.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.136 1.774 . . . . 0.0 110.849 171.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -158.51 161.92 37.41 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 124.064 0.945 . . . . 0.0 112.916 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.7 mm -80.08 145.05 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.563 1.145 . . . . 0.0 108.849 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 70.2 mtp -135.81 143.38 45.14 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.209 1.003 . . . . 0.0 111.636 175.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.45 166.25 20.92 Favored Pre-proline 0 N--CA 1.483 1.192 0 C-N-CA 126.223 1.809 . . . . 0.0 111.177 -169.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.63 163.4 24.49 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.725 2.284 . . . . 0.0 113.285 171.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.41 -84.37 0.09 OUTLIER Glycine 0 N--CA 1.472 1.059 0 C-N-CA 123.86 0.743 . . . . 0.0 114.292 176.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 10.8 mmpt? -61.41 -31.31 71.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.712 0.805 . . . . 0.0 113.013 -176.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.7 t -158.0 140.67 10.6 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 124.456 1.103 . . . . 0.0 111.37 169.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -81.93 5.17 6.49 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 124.055 3.17 . . . . 0.0 112.52 169.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.2 m -62.56 -27.9 69.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -171.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -159.58 -49.74 0.05 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -148.23 -74.93 0.18 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -169.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -8.64 83.02 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 129.261 3.024 . . . . 0.0 116.454 -169.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -66.3 161.02 23.27 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.486 1.514 . . . . 0.0 114.693 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 41.4 t -140.36 142.34 29.16 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 128.262 2.625 . . . . 0.0 107.626 174.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.6 43.15 0.63 Allowed 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.854 3.702 . . . . 0.0 113.172 173.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.6 tp 52.92 -90.01 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.395 2.678 . . . . 0.0 112.665 -169.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 51.31 12.96 0.16 Allowed 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -66.61 -23.39 66.17 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.64 -1.287 . . . . 0.0 113.394 173.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -141.02 -38.96 0.41 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.753 1.621 . . . . 0.0 111.411 172.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 40.06 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.337 1.855 . . . . 0.0 112.579 169.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.88 -25.04 0.26 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 128.982 2.913 . . . . 0.0 118.787 -168.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -140.48 18.5 2.38 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.923 1.289 . . . . 0.0 111.76 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -146.03 18.38 1.42 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.756 1.223 . . . . 0.0 114.256 -169.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.4 p -68.28 -35.48 77.92 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.911 -1.118 . . . . 0.0 112.539 171.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -68.92 119.45 13.27 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.177 1.391 . . . . 0.0 111.229 170.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -138.14 179.94 6.15 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.009 1.724 . . . . 0.0 111.249 -170.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -136.91 178.74 6.84 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.817 2.047 . . . . 0.0 110.127 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -144.03 -46.79 0.27 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.42 163.24 21.29 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -169.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -143.03 -17.67 0.66 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.115 1.366 . . . . 0.0 114.445 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -132.06 14.87 4.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.649 1.58 . . . . 0.0 112.317 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.5 mt -118.87 162.42 18.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.538 1.135 . . . . 0.0 113.613 -175.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.8 t -138.23 133.87 33.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 128.008 2.523 . . . . 0.0 107.385 169.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.21 144.05 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 111.081 -169.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -137.79 149.78 46.67 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.99 1.716 . . . . 0.0 110.226 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.6 mt -126.72 151.82 47.65 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.419 1.088 . . . . 0.0 112.069 -172.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -143.61 128.0 9.45 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.654 1.582 . . . . 0.0 110.016 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -79.1 -3.99 37.06 Favored 'Cis proline' 0 CA--C 1.547 1.169 0 CA-C-N 120.544 1.23 . . . . 0.0 113.36 -9.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -62.26 157.39 19.67 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -169.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -89.2 124.11 65.54 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 126.849 2.06 . . . . 0.0 109.968 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.23 81.59 2.42 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.465 2.777 . . . . 0.0 110.962 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -152.66 149.17 28.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.958 1.303 . . . . 0.0 112.529 -171.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -80.73 54.63 2.17 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.111 -0.993 . . . . 0.0 112.574 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 m -70.89 31.36 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.749 2.42 . . . . 0.0 115.305 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 58.68 15.97 4.06 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.017 2.127 . . . . 0.0 114.575 -172.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -149.22 162.38 29.11 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 125.539 1.536 . . . . 0.0 111.634 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.23 159.59 40.37 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.552 2.168 . . . . 0.0 110.668 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -85.54 -54.49 4.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.793 0.837 . . . . 0.0 109.895 171.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.6 t -83.03 137.73 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.598 1.159 . . . . 0.0 109.254 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 78.8 t -130.5 142.6 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-O 121.621 0.724 . . . . 0.0 110.754 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -128.66 123.66 59.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 128.147 2.579 . . . . 0.0 109.343 -169.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.9 mt -80.77 159.52 25.15 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 111.452 170.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.11 -24.54 67.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.422 1.089 . . . . 0.0 113.636 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.16 -10.04 59.31 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.856 1.663 . . . . 0.0 113.502 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.04 4.56 59.98 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.603 1.097 . . . . 0.0 114.988 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -72.36 141.56 48.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.637 1.218 . . . . 0.0 109.042 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -130.73 153.36 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.938 1.295 . . . . 0.0 109.966 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.8 p -49.5 120.48 10.61 Favored Pre-proline 0 N--CA 1.473 0.686 0 C-N-CA 124.767 1.227 . . . . 0.0 111.76 169.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.9 76.67 3.66 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.824 3.016 . . . . 0.0 111.901 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -115.88 -178.53 3.42 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.994 1.718 . . . . 0.0 112.797 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.2 m -138.8 150.85 46.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.141 0.972 . . . . 0.0 112.231 169.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.62 137.92 40.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 127.063 2.145 . . . . 0.0 108.389 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.6 tt -127.88 147.16 50.45 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.18 1.392 . . . . 0.0 110.475 -174.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.8 mtt -125.2 130.4 52.05 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 125.047 1.339 . . . . 0.0 109.46 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.08 146.7 50.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.921 1.689 . . . . 0.0 111.426 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -46.85 121.55 3.68 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.802 1.241 . . . . 0.0 111.145 171.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.04 -31.37 51.21 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -170.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.07 -21.24 7.84 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.614 0.626 . . . . 0.0 114.183 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.8 m -108.11 -21.71 12.68 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.902 0.881 . . . . 0.0 112.664 -169.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.29 -3.31 78.16 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.663 1.125 . . . . 0.0 114.951 173.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -69.47 122.11 84.51 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 125.599 1.56 . . . . 0.0 111.281 175.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -55.35 141.95 80.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.027 2.484 . . . . 0.0 113.082 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.07 -39.05 5.4 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.955 0.902 . . . . 0.0 110.267 169.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -149.97 154.69 38.67 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.08 1.352 . . . . 0.0 110.763 -169.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 6.6 m -139.42 145.0 38.35 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.898 1.679 . . . . 0.0 108.339 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.4 mt -123.24 134.79 54.08 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 127.408 2.283 . . . . 0.0 107.632 -175.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 7.7 t -136.02 138.82 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.488 0.715 . . . . 0.0 111.619 -168.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.0 t -114.82 124.98 53.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.221 1.008 . . . . 0.0 111.626 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 74.6 p -74.39 -16.83 60.88 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.171 1.389 . . . . 0.0 114.262 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.78 -1.1 12.13 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 125.504 1.526 . . . . 0.0 113.741 -169.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.6 t -154.93 158.77 39.78 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.093 -1.239 . . . . 0.0 113.054 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -59.92 137.21 90.61 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.127 1.771 . . . . 0.0 114.83 -178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -96.59 176.78 9.35 Favored 'Cis proline' 0 CA--C 1.548 1.191 0 CA-C-N 120.04 1.05 . . . . 0.0 111.026 -11.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.56 163.66 20.72 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.127 -0.983 . . . . 0.0 111.069 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -117.62 134.21 55.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.626 1.57 . . . . 0.0 111.23 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -89.49 146.08 24.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 111.855 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 t -150.36 147.99 28.26 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.151 1.38 . . . . 0.0 111.018 169.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.1 mp -74.76 128.81 36.46 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.557 -0.714 . . . . 0.0 109.116 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.02 63.42 0.26 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.281 1.832 . . . . 0.0 115.841 175.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.05 2.29 1.02 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.895 2.478 . . . . 0.0 116.74 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -54.11 -27.15 31.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -169.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.99 5.49 12.86 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.568 1.547 . . . . 0.0 112.582 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -71.51 -47.72 12.76 Favored Pre-proline 0 N--CA 1.476 0.835 0 CA-C-O 116.568 -1.682 . . . . 0.0 114.761 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 C--O 1.25 1.124 0 C-N-CA 122.546 2.164 . . . . 0.0 113.11 -179.158 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.488 1.461 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.46 -42.89 99.79 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.263 -0.898 . . . . 0.0 112.772 176.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.4 p90 -69.39 -23.58 63.74 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.92 160.66 25.24 Favored Glycine 0 CA--C 1.529 0.94 0 CA-C-N 119.226 0.921 . . . . 0.0 113.847 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.2 mtm-85 -131.0 82.69 2.06 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.648 1.979 . . . . 0.0 109.756 -171.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -49.31 -42.93 42.84 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 -170.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.99 -40.64 87.43 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.66 -45.88 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.225 0.61 . . . . 0.0 109.774 173.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.3 -46.55 88.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.545 0.738 . . . . 0.0 112.565 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -58.39 -51.49 69.58 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.615 0.766 . . . . 0.0 112.331 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.9 m -57.86 -47.6 82.26 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.362 0.665 . . . . 0.0 111.319 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -70.5 -29.27 65.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.854 1.261 . . . . 0.0 113.912 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.7 -49.28 71.5 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 120.576 1.535 . . . . 0.0 110.461 171.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -62.48 -40.54 97.01 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.768 1.227 . . . . 0.0 111.936 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -63.23 -47.83 80.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.598 1.159 . . . . 0.0 112.298 172.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.2 m -57.7 -40.66 80.03 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.067 0.947 . . . . 0.0 111.204 175.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.36 78.41 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.09 -44.63 96.25 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.566 -0.709 . . . . 0.0 111.665 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -68.28 -39.33 82.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.632 0.773 . . . . 0.0 112.42 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.04 -45.24 91.25 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.69 0.677 . . . . 0.0 111.83 169.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -60.81 -42.99 98.73 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.858 0.754 . . . . 0.0 110.73 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.94 -40.18 94.65 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.957 -1.089 . . . . 0.0 113.538 172.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.96 -31.13 71.86 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.27 1.028 . . . . 0.0 113.092 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.7 tp -73.33 -35.72 66.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.279 1.432 . . . . 0.0 111.427 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -62.11 -45.2 94.54 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.082 -1.011 . . . . 0.0 110.88 169.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 tp -51.9 -46.35 64.55 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.441 1.496 . . . . 0.0 111.075 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.82 97.73 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.26 -44.2 99.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.687 0.795 . . . . 0.0 110.598 175.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.56 -49.88 76.07 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.265 0.626 . . . . 0.0 111.562 174.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.0 mmt85 -59.28 -34.81 72.72 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.036 -1.04 . . . . 0.0 112.414 175.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.52 66.96 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.132 0.878 . . . . 0.0 111.765 178.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -25.04 63.11 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.633 -0.667 . . . . 0.0 112.523 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.7 mt -81.93 -43.08 18.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.682 1.193 . . . . 0.0 112.381 175.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.5 p -84.24 -17.5 39.58 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -173.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.87 11.68 83.48 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 175.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.89 172.56 6.18 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.185 1.394 . . . . 0.0 110.147 171.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.13 159.64 14.76 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.455 2.103 . . . . 0.0 114.907 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.6 t -130.52 156.49 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 127.249 2.219 . . . . 0.0 107.53 171.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.99 169.78 35.3 Favored Glycine 0 N--CA 1.468 0.814 0 CA-C-N 120.323 1.42 . . . . 0.0 116.256 -171.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.43 128.85 66.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 125.178 1.391 . . . . 0.0 108.829 -173.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -107.64 59.95 0.62 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 129.178 2.991 . . . . 0.0 110.635 -168.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -53.84 141.13 28.19 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.3 1.04 . . . . 0.0 112.056 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.5 t -139.42 179.52 6.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.067 1.747 . . . . 0.0 111.769 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -66.64 -16.93 64.55 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -169.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.0 p -142.81 -5.02 0.92 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.76 -175.36 5.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.065 1.746 . . . . 0.0 110.599 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -146.07 164.82 30.92 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.697 1.599 . . . . 0.0 109.851 173.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.6 ttp-105 -148.45 154.97 40.6 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.104 1.762 . . . . 0.0 109.814 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.3 mt -114.82 141.18 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.576 1.151 . . . . 0.0 109.272 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 85.3 mtp -132.6 148.33 52.36 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 -174.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.8 158.28 37.43 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.777 2.431 . . . . 0.0 108.86 -168.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.51 153.09 79.01 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 122.104 1.869 . . . . 0.0 112.034 169.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.3 4.72 0.98 Allowed Glycine 0 CA--C 1.537 1.406 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -137.59 -23.71 1.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.6 t -158.21 139.09 9.39 Favored Pre-proline 0 N--CA 1.477 0.911 0 CA-C-N 119.44 1.018 . . . . 0.0 112.829 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.63 -12.78 3.56 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.299 3.333 . . . . 0.0 112.187 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.7 t -82.96 -22.38 33.77 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.056 1.342 . . . . 0.0 113.479 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.78 162.06 37.69 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.349 1.46 . . . . 0.0 111.721 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -52.4 123.34 10.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.472 1.509 . . . . 0.0 112.429 177.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -153.23 160.18 42.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.518 1.527 . . . . 0.0 111.86 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -145.28 146.24 31.57 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.693 1.197 . . . . 0.0 113.6 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.1 t -158.01 153.65 22.66 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.993 2.917 . . . . 0.0 107.724 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -69.52 134.64 28.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.236 1.958 . . . . 0.0 111.064 173.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.456 ' O ' HD23 ' A' ' 64' ' ' LEU . 2.4 tt -68.68 -26.28 65.22 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 123.328 1.537 . . . . 0.0 109.787 173.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -49.52 -14.31 0.11 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 127.968 2.507 . . . . 0.0 113.746 169.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -53.54 -32.74 51.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.929 1.692 . . . . 0.0 112.753 168.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -135.27 -13.04 2.1 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -176.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -121.58 58.24 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.209 1.403 . . . . 0.0 109.074 169.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.63 -23.43 1.01 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 -169.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -121.16 -4.2 9.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -171.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -129.08 -7.0 4.89 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.9 m -75.55 14.37 0.63 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.251 1.02 . . . . 0.0 113.603 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -155.63 -179.2 7.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.42 1.488 . . . . 0.0 110.988 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -51.93 128.02 22.93 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -168.86 -27.86 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.086 2.154 . . . . 0.0 111.439 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -69.23 -6.25 27.96 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.545 1.938 . . . . 0.0 114.796 -170.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.88 165.44 24.63 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.895 1.678 . . . . 0.0 113.442 -178.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.56 13.22 2.13 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.32 1.448 . . . . 0.0 112.841 171.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -155.09 3.48 0.2 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -168.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -120.19 162.87 18.62 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.292 -1.505 . . . . 0.0 113.482 -169.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 t -135.98 143.3 44.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.043 2.137 . . . . 0.0 108.735 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.9 143.88 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.116 1.366 . . . . 0.0 110.641 -169.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -140.17 134.51 31.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.352 1.461 . . . . 0.0 110.601 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mp -113.41 153.03 29.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.235 1.017 . . . . 0.0 113.15 -174.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -145.45 140.34 15.81 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 126.875 2.07 . . . . 0.0 108.745 -172.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -80.1 -5.95 41.37 Favored 'Cis proline' 0 CA--C 1.546 1.077 0 CA-C-N 120.841 1.336 . . . . 0.0 114.015 -3.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -107.35 155.96 19.43 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.84 1.256 . . . . 0.0 113.305 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.82 135.49 95.46 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -84.16 98.23 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 123.633 2.889 . . . . 0.0 108.797 168.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -148.0 156.38 42.59 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.028 -1.045 . . . . 0.0 112.259 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 41.75 0.28 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.99 1.716 . . . . 0.0 112.093 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 55.5 p -73.2 39.18 0.09 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.622 1.969 . . . . 0.0 115.281 -171.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.6 t30 57.33 19.5 5.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 127.022 2.129 . . . . 0.0 115.015 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -158.04 124.33 2.49 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.626 1.17 . . . . 0.0 110.429 -169.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.89 128.94 30.92 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 121.712 1.608 . . . . 0.0 111.212 172.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -78.34 -39.24 40.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.953 0.901 . . . . 0.0 111.311 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -99.98 136.23 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.896 1.678 . . . . 0.0 108.174 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.5 t -135.54 143.82 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 121.868 0.842 . . . . 0.0 111.108 -172.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -125.49 129.56 72.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 128.384 2.674 . . . . 0.0 107.968 -171.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.4 mt -94.08 162.62 13.8 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.097 0.951 . . . . 0.0 112.061 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.74 -9.41 6.36 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -175.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -121.12 9.74 10.57 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.746 1.619 . . . . 0.0 113.298 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.74 8.69 59.22 Favored Glycine 0 CA--C 1.535 1.304 0 N-CA-C 115.833 1.093 . . . . 0.0 115.833 173.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -74.93 137.8 41.92 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.9 1.35 . . . . 0.0 108.551 169.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.37 146.11 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.909 1.284 . . . . 0.0 109.479 -173.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.2 p -52.24 124.37 30.77 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 124.022 0.929 . . . . 0.0 111.539 170.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.64 112.87 3.59 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.742 2.295 . . . . 0.0 111.096 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.563 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.5 p90 -151.45 -179.27 7.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.35 1.86 . . . . 0.0 111.661 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -138.19 142.48 40.03 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.622 0.769 . . . . 0.0 112.156 169.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.07 102.77 8.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 129.235 3.014 . . . . 0.0 108.833 -170.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -96.62 147.9 23.4 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.544 1.138 . . . . 0.0 110.563 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.4 mtt -129.85 135.48 48.44 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.879 1.672 . . . . 0.0 109.271 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.66 152.71 48.3 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.158 1.383 . . . . 0.0 111.0 -176.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -61.09 127.28 30.78 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 121.814 -0.554 . . . . 0.0 109.806 175.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.97 -20.34 57.11 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -175.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.85 -32.65 0.68 Allowed Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.301 0.953 . . . . 0.0 114.582 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 6.9 m -68.38 -27.47 66.26 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.257 1.528 . . . . 0.0 111.255 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 70.55 35.82 68.06 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.806 0.717 . . . . 0.0 113.195 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -133.34 135.61 25.7 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 125.668 1.587 . . . . 0.0 110.439 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.41 152.33 79.0 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.012 2.475 . . . . 0.0 113.071 -176.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.34 -55.21 1.76 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.214 1.805 . . . . 0.0 111.565 -173.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -147.98 156.47 42.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 108.643 -169.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.6 m -147.46 138.56 23.65 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.059 -1.026 . . . . 0.0 110.243 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -109.61 146.21 35.13 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 126.814 2.046 . . . . 0.0 109.729 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 54.0 t -140.38 137.17 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.098 0.959 . . . . 0.0 112.038 -169.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.563 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 38.4 t -115.27 154.26 29.41 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.906 1.682 . . . . 0.0 111.641 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.4 m -130.35 9.52 5.18 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.944 1.298 . . . . 0.0 113.488 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.87 -9.61 10.45 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 114.943 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.9 p -156.53 160.07 39.15 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.637 1.219 . . . . 0.0 113.517 -173.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.0 t-105 -60.23 138.5 91.65 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.297 1.839 . . . . 0.0 115.501 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -97.9 177.22 7.93 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.128 1.081 . . . . 0.0 110.935 -11.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.26 160.26 32.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.855 169.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -100.81 166.04 11.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.065 1.346 . . . . 0.0 109.046 169.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -142.07 153.12 43.94 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.2 t -155.86 167.09 31.53 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.233 1.413 . . . . 0.0 112.254 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.89 135.85 48.25 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 109.971 169.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.98 70.5 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.724 2.41 . . . . 0.0 116.547 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 46.4 ptt85 44.03 31.6 0.54 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 128.798 2.839 . . . . 0.0 118.398 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -55.37 -24.04 27.58 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 174.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.6 p -97.43 -0.89 45.43 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.822 2.049 . . . . 0.0 113.759 176.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -138.54 62.18 28.17 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 126.33 1.852 . . . . 0.0 110.743 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.268 3.312 . . . . 0.0 113.369 178.968 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.22 165.84 33.59 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.063 1.345 . . . . 0.0 111.525 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -128.44 17.34 6.48 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.065 1.346 . . . . 0.0 113.385 -177.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.33 36.05 0.44 Allowed Glycine 0 CA--C 1.538 1.477 0 C-N-CA 126.575 2.036 . . . . 0.0 115.763 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.7 mtt-85 -61.45 -14.29 27.37 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.365 1.866 . . . . 0.0 114.357 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -51.1 -28.16 10.02 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -175.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.8 -13.51 34.29 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.865 1.266 . . . . 0.0 114.084 172.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -131.71 -44.2 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.681 1.992 . . . . 0.0 111.181 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.56 79.58 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.448 1.499 . . . . 0.0 113.331 -177.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -65.55 -44.79 85.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.158 0.89 . . . . 0.0 111.207 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.3 m -62.01 -45.82 91.94 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.282 -0.886 . . . . 0.0 111.593 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -60.04 -38.55 83.1 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.328 -0.844 . . . . 0.0 112.253 175.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.81 -47.27 87.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.493 1.042 . . . . 0.0 112.032 174.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -63.54 -41.4 98.45 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.217 1.007 . . . . 0.0 111.379 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.98 -53.32 51.97 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 122.694 0.398 . . . . 0.0 111.782 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.0 m -55.76 -37.12 68.1 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.964 1.306 . . . . 0.0 111.425 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.14 -47.74 83.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.38 1.072 . . . . 0.0 113.89 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.81 98.13 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.389 -0.819 . . . . 0.0 112.254 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -65.08 -42.59 93.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.485 0.714 . . . . 0.0 110.959 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -60.08 -43.71 95.3 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.199 0.6 . . . . 0.0 112.408 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 34.9 m -59.82 -41.79 92.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 118.597 0.635 . . . . 0.0 111.156 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.39 -40.88 94.02 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.864 -1.148 . . . . 0.0 113.5 172.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.75 -33.51 75.82 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.171 -0.956 . . . . 0.0 113.041 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.49 -35.85 75.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.448 1.099 . . . . 0.0 111.742 173.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.36 -44.22 95.44 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.91 -1.119 . . . . 0.0 111.773 170.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.57 -45.15 62.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.188 1.395 . . . . 0.0 111.471 169.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.09 98.11 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.64 -45.79 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 118.898 0.772 . . . . 0.0 110.713 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.87 -23.95 66.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -103.03 -24.78 13.61 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.33 74.59 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.983 1.265 . . . . 0.0 113.801 176.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.7 t -69.4 -28.28 66.02 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 121.637 -0.664 . . . . 0.0 112.73 173.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.4 mt -85.2 -28.59 25.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.518 1.527 . . . . 0.0 113.219 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -86.44 -15.73 39.34 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -169.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.1 -9.3 33.3 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 124.507 1.051 . . . . 0.0 115.266 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -138.32 150.84 68.03 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 129.447 3.099 . . . . 0.0 105.406 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -40.41 154.97 0.05 OUTLIER 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.099 3.199 . . . . 0.0 115.507 169.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.9 t -104.01 161.84 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.871 1.268 . . . . 0.0 108.311 171.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -154.44 176.28 32.3 Favored Glycine 0 CA--C 1.522 0.521 0 CA-C-O 122.299 0.944 . . . . 0.0 114.991 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 63.2 mt -134.95 118.42 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 124.504 1.122 . . . . 0.0 108.002 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -76.8 152.97 35.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.347 1.459 . . . . 0.0 110.687 170.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -143.02 147.85 35.79 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.391 1.477 . . . . 0.0 113.03 -175.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.7 p -136.58 -176.36 4.32 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.569 1.948 . . . . 0.0 111.302 176.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.63 -25.29 62.55 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 178.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.6 p -143.2 -2.09 1.02 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -173.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.73 179.87 7.15 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.86 1.314 . . . . 0.0 112.988 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.482 ' CZ2' ' HA ' ' A' ' 74' ' ' ASN . 58.6 p-90 -149.15 162.78 39.3 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.303 2.241 . . . . 0.0 108.762 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 41.8 mtm-85 -143.96 132.04 21.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.402 1.081 . . . . 0.0 111.208 172.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.3 mm -69.76 130.82 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 171.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.8 mtm -134.11 147.79 50.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 122.077 0.942 . . . . 0.0 111.719 -176.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.7 164.83 33.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.912 1.285 . . . . 0.0 111.786 -169.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.03 -23.41 75.68 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.755 2.97 . . . . 0.0 114.527 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.86 -53.53 1.69 Allowed Glycine 0 CA--C 1.533 1.201 0 C-N-CA 126.929 2.204 . . . . 0.0 116.556 169.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -142.62 -23.05 0.66 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.294 1.437 . . . . 0.0 114.299 -172.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.3 t -133.32 124.12 18.06 Favored Pre-proline 0 N--CA 1.475 0.805 0 CA-C-N 119.021 0.828 . . . . 0.0 113.021 -174.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -86.55 -0.02 8.04 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.82 3.013 . . . . 0.0 111.929 169.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.7 m -111.74 -5.22 14.46 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.662 1.585 . . . . 0.0 114.262 -169.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -141.79 146.04 35.46 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.064 1.346 . . . . 0.0 110.839 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -51.27 -37.26 46.33 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.95 1.7 . . . . 0.0 115.047 -171.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 9.2 tpt85 -27.32 96.97 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 129.007 2.923 . . . . 0.0 115.241 -171.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.22 154.82 34.97 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.305 1.042 . . . . 0.0 112.124 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.6 m -143.82 151.0 51.97 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 125.886 1.674 . . . . 0.0 110.164 169.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.14 145.87 80.02 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.183 1.922 . . . . 0.0 110.21 169.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 63.6 tp -57.12 -71.84 0.09 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.337 1.055 . . . . 0.0 113.595 -169.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 43.83 1.79 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 130.612 3.565 . . . . 0.0 120.45 169.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -60.42 -21.76 62.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.499 1.919 . . . . 0.0 115.351 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -150.35 -38.94 0.14 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.951 1.701 . . . . 0.0 110.698 170.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.78 44.35 0.08 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.112 2.165 . . . . 0.0 113.12 169.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.31 20.44 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 -169.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -133.36 25.96 4.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.084 1.354 . . . . 0.0 112.033 170.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -120.19 -6.89 9.89 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.848 1.659 . . . . 0.0 111.679 173.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.9 m -71.16 -2.12 14.75 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.804 1.642 . . . . 0.0 113.123 169.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -139.5 168.99 18.58 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.571 1.548 . . . . 0.0 113.253 -175.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.482 ' HA ' ' CZ2' ' A' ' 47' ' ' TRP . 59.0 t30 -51.13 119.55 4.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 117.307 2.336 . . . . 0.0 117.307 -169.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -141.72 10.19 2.01 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.54 2.336 . . . . 0.0 111.459 169.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -79.52 -17.23 54.5 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.03 1.332 . . . . 0.0 113.529 -176.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.11 167.3 28.15 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -144.08 27.71 1.43 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.802 2.041 . . . . 0.0 110.247 169.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -141.45 -5.81 1.06 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.442 1.497 . . . . 0.0 114.636 -169.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.2 mt -115.3 163.4 15.74 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.865 1.317 . . . . 0.0 113.614 -170.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.2 t -134.38 134.79 42.1 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 128.672 2.789 . . . . 0.0 106.797 169.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.51 144.26 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.421 1.088 . . . . 0.0 110.884 -169.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -137.36 157.4 46.67 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.028 1.731 . . . . 0.0 109.585 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -153.71 168.56 25.84 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.546 -0.721 . . . . 0.0 112.902 172.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -157.65 155.08 26.43 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.525 1.93 . . . . 0.0 110.269 177.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -77.46 -10.75 31.7 Favored 'Cis proline' 0 CA--C 1.543 0.946 0 CA-C-N 120.898 1.357 . . . . 0.0 114.864 2.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -66.1 -178.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.303 1.441 . . . . 0.0 111.586 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.73 141.11 29.63 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -176.024 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.39 131.44 24.8 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.825 2.35 . . . . 0.0 110.407 175.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -160.38 -154.52 0.38 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.587 0.755 . . . . 0.0 111.523 -169.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -135.71 26.81 3.36 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.954 2.502 . . . . 0.0 110.148 169.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.2 m -60.37 156.87 14.9 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.124 2.17 . . . . 0.0 115.086 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -71.96 20.05 0.06 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 126.031 1.732 . . . . 0.0 114.84 175.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -150.36 161.29 31.11 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.379 1.872 . . . . 0.0 109.823 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.99 172.07 16.24 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 122.902 2.402 . . . . 0.0 112.964 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -108.64 -10.58 15.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.87 1.668 . . . . 0.0 111.958 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.56 139.33 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.238 1.415 . . . . 0.0 108.811 169.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.443 ' H ' HG22 ' A' ' 106' ' ' THR . 58.8 t -134.31 139.3 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 109.577 -175.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.92 119.16 48.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 126.635 1.974 . . . . 0.0 109.5 -169.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.64 152.27 40.55 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.373 1.469 . . . . 0.0 111.187 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.01 -28.64 58.15 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.895 1.278 . . . . 0.0 114.127 172.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.94 -11.31 59.59 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.628 1.571 . . . . 0.0 113.58 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.25 4.77 59.62 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 124.648 1.118 . . . . 0.0 114.887 -177.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -72.24 150.99 43.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.491 1.145 . . . . 0.0 108.408 169.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -128.82 137.55 56.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 124.774 1.23 . . . . 0.0 108.427 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.443 HG22 ' H ' ' A' ' 98' ' ' VAL . 6.3 t -56.26 133.34 75.61 Favored Pre-proline 0 CA--C 1.544 0.75 0 CA-C-O 118.522 -0.752 . . . . 0.0 111.255 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -59.94 117.53 4.29 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.562 2.175 . . . . 0.0 112.82 174.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 5.6 p90 -155.13 175.6 13.63 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.448 1.499 . . . . 0.0 111.356 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 p -142.14 153.2 43.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.499 1.12 . . . . 0.0 110.508 169.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.12 134.67 33.18 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.884 2.073 . . . . 0.0 109.142 -169.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -125.71 143.17 51.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.461 1.504 . . . . 0.0 110.383 -175.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.4 mtt -122.07 128.98 51.98 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.556 1.542 . . . . 0.0 109.667 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.11 146.16 50.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.64 1.576 . . . . 0.0 111.573 -175.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -54.18 124.98 17.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.48 1.112 . . . . 0.0 109.927 171.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.55 -14.07 17.76 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 -174.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -103.9 -50.05 1.04 Allowed Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.917 1.246 . . . . 0.0 113.417 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.4 p -79.45 -27.77 41.62 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.442 1.121 . . . . 0.0 113.558 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.97 8.27 73.05 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.987 0.803 . . . . 0.0 113.01 -169.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.38 134.66 58.22 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 124.901 1.28 . . . . 0.0 110.836 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.57 144.13 65.38 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.787 2.325 . . . . 0.0 112.663 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.24 -40.38 4.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.922 0.889 . . . . 0.0 110.125 169.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.45 154.81 38.36 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.327 1.051 . . . . 0.0 111.383 -169.028 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.9 m -145.75 145.78 30.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.966 1.307 . . . . 0.0 109.986 177.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.5 mp -120.17 144.55 47.63 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.122 2.569 . . . . 0.0 109.365 -179.155 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 15.9 t -142.23 138.07 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.253 1.021 . . . . 0.0 111.581 -170.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 10.6 t -116.7 152.89 33.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.432 1.093 . . . . 0.0 112.234 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 39.6 m -130.5 5.86 4.77 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.312 1.445 . . . . 0.0 113.19 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.85 -15.25 5.43 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 115.915 1.126 . . . . 0.0 115.915 172.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.2 t -151.64 159.04 44.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.76 1.78 . . . . 0.0 113.798 -172.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 -57.5 135.28 82.02 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 126.465 1.906 . . . . 0.0 115.524 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -96.28 175.98 10.34 Favored 'Cis proline' 0 CA--C 1.547 1.146 0 CA-C-N 120.139 1.086 . . . . 0.0 110.603 -11.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.43 161.75 22.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.245 1.022 . . . . 0.0 112.085 169.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -90.12 154.79 19.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.208 1.403 . . . . 0.0 107.788 169.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -139.44 152.54 47.12 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.3 t -155.18 151.35 28.09 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.692 1.197 . . . . 0.0 112.031 -169.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.98 131.92 45.85 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 169.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.57 66.08 0.12 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.628 1.971 . . . . 0.0 115.267 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 52.05 13.77 0.29 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 118.58 2.808 . . . . 0.0 118.58 178.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -57.51 -32.17 66.76 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -169.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 68.3 p -79.77 -18.21 51.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 68.4 ttt-85 -66.73 -47.03 56.54 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-O 116.54 -1.695 . . . . 0.0 115.263 -171.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo . . . . . 0 C--O 1.249 1.071 0 C-N-CA 122.729 2.286 . . . . 0.0 113.223 -178.428 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.569 -0.16 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.56 167.85 24.31 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.131 1.372 . . . . 0.0 111.75 177.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -67.98 -14.51 63.02 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -167.03 -174.7 36.47 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.534 1.54 . . . . 0.0 112.824 -178.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -78.28 57.85 1.97 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.744 1.618 . . . . 0.0 113.969 -170.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -46.54 -42.48 15.85 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.796 2.038 . . . . 0.0 114.385 -178.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -66.57 -42.07 87.62 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.24 -40.05 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.716 -0.659 . . . . 0.0 109.987 175.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.3 95.95 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.311 0.959 . . . . 0.0 112.659 173.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.19 -42.43 96.65 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.049 -1.032 . . . . 0.0 111.575 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.0 m -61.16 -50.37 73.42 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.745 0.818 . . . . 0.0 111.711 173.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -57.46 -40.4 78.44 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.914 1.686 . . . . 0.0 112.408 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.98 72.01 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.989 0.813 . . . . 0.0 111.376 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -61.73 -41.69 97.99 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.129 0.972 . . . . 0.0 111.876 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.47 -50.01 71.38 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.767 1.227 . . . . 0.0 112.538 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 61.8 m -65.28 -30.26 71.11 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.237 -0.915 . . . . 0.0 112.113 174.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.9 87.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.679 1.127 . . . . 0.0 113.496 172.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.85 -43.76 98.2 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.35 -0.844 . . . . 0.0 111.372 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -64.76 -39.2 93.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.525 0.73 . . . . 0.0 112.664 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -61.31 -42.5 98.77 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 111.774 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.8 m -59.32 -43.86 92.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.424 0.556 . . . . 0.0 110.727 175.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -41.87 96.5 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.981 -1.075 . . . . 0.0 113.474 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.86 -32.71 74.32 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.997 0.919 . . . . 0.0 113.128 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.9 tp -73.04 -33.87 65.96 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.06 1.344 . . . . 0.0 111.683 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.41 -44.23 95.26 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.948 -1.095 . . . . 0.0 110.877 169.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.7 -45.33 66.82 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.34 1.456 . . . . 0.0 111.288 169.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.61 98.03 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.92 -47.29 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.088 0.858 . . . . 0.0 110.684 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -60.34 -35.44 75.65 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.708 0.803 . . . . 0.0 112.796 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -76.29 -36.63 58.26 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.389 0.676 . . . . 0.0 112.626 174.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.92 -36.06 82.72 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.833 1.197 . . . . 0.0 112.96 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -73.32 -27.32 61.46 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.9 -25.34 23.3 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.9 m -89.28 -22.07 22.88 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -169.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.75 5.85 89.27 Favored Glycine 0 CA--C 1.542 1.734 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -143.44 150.81 52.67 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 127.653 2.381 . . . . 0.0 107.302 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -46.24 163.25 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.761 2.974 . . . . 0.0 114.593 169.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -123.37 160.72 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.616 1.566 . . . . 0.0 108.459 176.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.63 173.75 34.37 Favored Glycine 0 CA--C 1.521 0.458 0 N-CA-C 116.111 1.204 . . . . 0.0 116.111 -177.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.2 mt -132.63 123.66 49.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.832 1.253 . . . . 0.0 108.998 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -83.48 145.76 28.76 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.597 1.959 . . . . 0.0 110.758 170.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -141.55 145.2 34.82 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.311 1.445 . . . . 0.0 111.801 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.2 p -146.83 176.12 10.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.996 1.318 . . . . 0.0 112.056 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -61.09 -10.11 5.66 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.445 1.098 . . . . 0.0 113.86 170.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.9 m -130.7 -15.8 3.44 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.92 168.73 24.82 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 123.178 1.466 . . . . 0.0 114.079 -178.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -135.74 144.33 45.8 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.904 2.882 . . . . 0.0 105.478 169.231 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -160.01 129.62 5.26 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.674 0.79 . . . . 0.0 111.508 -172.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mt -92.57 139.36 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.2 mtp -136.66 145.27 44.59 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.038 0.935 . . . . 0.0 112.189 -169.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 m -138.46 160.79 62.22 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 126.574 1.95 . . . . 0.0 112.137 -169.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -81.17 12.04 2.82 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.048 3.165 . . . . 0.0 115.406 -171.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -39.66 -40.17 1.44 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 127.005 2.24 . . . . 0.0 118.687 -169.34 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -69.1 -44.5 72.35 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.219 1.51 . . . . 0.0 112.895 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -167.92 129.87 1.24 Allowed Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 123.935 0.894 . . . . 0.0 112.83 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.2 -24.6 6.55 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.029 2.486 . . . . 0.0 111.725 169.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.4 m -75.18 -24.86 57.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.542 1.537 . . . . 0.0 113.517 -175.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.48 21.06 4.73 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.339 1.455 . . . . 0.0 112.674 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . 0.27 0.0 OUTLIER 54.08 -13.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 131.567 3.947 . . . . 0.0 120.288 173.475 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -38.74 110.01 0.12 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 128.062 2.545 . . . . 0.0 114.198 -170.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.87 153.92 40.64 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.172 1.389 . . . . 0.0 113.92 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 t -136.49 140.59 32.84 Favored Pre-proline 0 N--CA 1.469 0.495 0 C-N-CA 126.891 2.076 . . . . 0.0 108.194 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -63.53 151.71 83.69 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 CA-C-N 121.156 1.449 . . . . 0.0 109.716 169.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 15.8 tp -65.65 12.7 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -176.275 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -61.38 -13.53 20.64 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.022 -1.674 . . . . 0.0 114.077 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.58 -15.09 24.3 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.358 1.063 . . . . 0.0 113.424 169.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -141.58 -44.59 0.36 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.091 1.356 . . . . 0.0 112.389 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.56 47.69 1.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.212 1.805 . . . . 0.0 111.697 173.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.7 -35.15 1.71 Allowed 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 -169.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -129.08 15.25 6.26 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.212 1.405 . . . . 0.0 112.578 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -143.46 6.05 1.45 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -174.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 82.6 p -58.18 -20.13 38.69 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -157.95 168.89 25.87 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.49 1.516 . . . . 0.0 113.48 -169.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.81 -41.1 0.07 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.84 3.256 . . . . 0.0 118.008 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -73.19 70.42 1.12 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.309 1.844 . . . . 0.0 111.331 176.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -129.15 -28.71 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -168.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.58 176.65 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.413 1.006 . . . . 0.0 113.642 -176.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -125.93 -25.04 3.67 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.579 1.952 . . . . 0.0 113.477 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -139.17 14.53 2.62 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.383 1.073 . . . . 0.0 113.599 -169.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -124.16 156.19 37.14 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -168.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.3 m -133.01 134.3 44.25 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.565 2.746 . . . . 0.0 107.806 169.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -113.37 141.51 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.366 1.066 . . . . 0.0 110.55 -169.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -140.1 85.56 2.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.554 1.542 . . . . 0.0 110.426 -170.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.3 157.22 37.43 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.928 -1.107 . . . . 0.0 112.486 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.82 145.34 27.45 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.852 1.661 . . . . 0.0 109.365 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.56 -14.29 24.46 Favored 'Cis proline' 0 CA--C 1.543 0.975 0 CA-C-N 120.076 1.063 . . . . 0.0 113.825 -4.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -60.62 119.95 9.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.142 1.377 . . . . 0.0 112.328 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.43 145.83 85.89 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.262 1.025 . . . . 0.0 113.505 -177.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.92 63.96 8.73 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 124.311 3.341 . . . . 0.0 112.386 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -147.67 159.13 44.12 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.158 1.383 . . . . 0.0 111.735 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -74.34 89.63 2.1 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.655 1.217 . . . . 0.0 113.594 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 p -61.02 -3.41 0.79 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 128.043 2.537 . . . . 0.0 116.224 171.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 2.6 p30 54.31 6.9 0.12 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.476 2.31 . . . . 0.0 115.82 -169.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -140.84 165.37 30.04 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 128.66 2.784 . . . . 0.0 108.23 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.2 155.09 65.26 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-N 120.094 1.069 . . . . 0.0 112.155 169.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -102.37 -44.55 5.36 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.595 1.158 . . . . 0.0 110.72 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.79 135.72 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.47 ' H ' HG22 ' A' ' 106' ' ' THR . 89.7 t -136.04 139.12 46.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.684 1.194 . . . . 0.0 109.745 -177.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.5 119.43 50.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 127.578 2.351 . . . . 0.0 108.206 -170.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -83.23 159.55 21.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.768 0.794 . . . . 0.0 111.355 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.25 -26.12 50.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.074 1.349 . . . . 0.0 114.449 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -76.01 -16.67 59.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.805 1.642 . . . . 0.0 113.595 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.05 7.14 64.41 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.331 0.967 . . . . 0.0 114.498 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -84.66 143.23 29.35 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 169.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.4 mm -125.75 149.77 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.14 1.376 . . . . 0.0 109.966 -168.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.47 HG22 ' H ' ' A' ' 98' ' ' VAL . 11.8 t -56.34 134.07 76.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 O-C-N 121.655 -0.653 . . . . 0.0 110.925 169.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -75.65 117.35 4.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.51 2.14 . . . . 0.0 111.216 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.518 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 10.1 p90 -149.05 179.09 8.14 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 127.055 2.142 . . . . 0.0 111.021 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -138.59 155.54 48.25 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 111.246 169.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.4 tp -136.97 103.72 5.24 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.875 2.07 . . . . 0.0 108.985 -169.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -95.19 147.09 23.83 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.364 0.665 . . . . 0.0 110.446 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 59.0 mtt -126.7 125.66 42.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.741 1.616 . . . . 0.0 110.392 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.79 140.1 52.25 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.205 1.402 . . . . 0.0 111.55 -176.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -64.52 119.38 10.34 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.142 0.977 . . . . 0.0 110.565 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.43 -22.03 52.93 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 178.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -84.38 -19.57 60.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.724 1.154 . . . . 0.0 115.269 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.2 p -135.18 -24.56 1.42 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.276 1.538 . . . . 0.0 114.445 -170.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 84.6 -1.78 88.56 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.975 1.274 . . . . 0.0 114.105 -172.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -79.45 138.97 55.18 Favored Pre-proline 0 CA--C 1.545 0.773 0 CA-C-N 118.682 1.241 . . . . 0.0 112.22 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.14 146.42 57.81 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.779 2.319 . . . . 0.0 111.642 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.94 -42.06 2.85 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.976 0.91 . . . . 0.0 111.265 174.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -148.86 159.73 43.9 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.589 1.156 . . . . 0.0 111.245 -168.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.8 m -148.2 139.99 23.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.728 1.211 . . . . 0.0 109.521 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.9 mp -109.55 144.82 37.32 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.524 1.93 . . . . 0.0 109.374 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 35.1 t -138.48 136.14 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.654 1.182 . . . . 0.0 111.366 -169.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.518 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 20.1 t -115.98 154.87 29.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.108 1.363 . . . . 0.0 111.843 178.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 m -131.98 9.95 4.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.187 1.395 . . . . 0.0 113.267 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 115.89 -6.75 19.81 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.85 1.214 . . . . 0.0 115.217 176.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 73.4 m -149.05 150.66 33.15 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.649 1.224 . . . . 0.0 113.33 -169.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -58.45 137.0 85.66 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 124.909 1.284 . . . . 0.0 114.41 173.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.17 174.66 11.54 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 CA-C-N 120.147 1.088 . . . . 0.0 111.032 -11.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.28 166.01 15.13 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.076 0.941 . . . . 0.0 110.937 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -110.54 165.05 12.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.999 1.32 . . . . 0.0 109.132 171.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -141.98 155.66 45.45 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.4 t -151.87 151.08 30.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.678 1.591 . . . . 0.0 111.005 -173.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.73 133.04 47.82 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 67.91 0.07 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.871 2.068 . . . . 0.0 115.431 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 0.0 OUTLIER 50.05 16.47 0.24 Allowed 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.28 -34.32 70.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.5 p -88.26 -12.31 44.02 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 174.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -61.8 134.91 94.2 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.011 0.925 . . . . 0.0 112.523 -169.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo . . . . . 0 C--O 1.25 1.088 0 C-N-CA 123.691 2.927 . . . . 0.0 113.264 168.878 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.28 167.26 4.24 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.323 1.049 . . . . 0.0 113.612 175.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 p90 -58.7 -27.55 64.95 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.756 1.222 . . . . 0.0 114.136 176.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -178.83 159.79 25.06 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.756 1.17 . . . . 0.0 112.643 176.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 54.0 mmm-85 -84.29 63.54 7.81 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.901 1.281 . . . . 0.0 112.389 -175.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -48.46 -41.23 28.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.175 0.99 . . . . 0.0 112.045 173.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.46 -11.59 16.94 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.801 2.04 . . . . 0.0 115.156 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.07 -44.44 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 125.652 1.581 . . . . 0.0 110.088 173.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.23 -38.42 86.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -56.23 -50.02 72.48 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.275 0.943 . . . . 0.0 112.65 172.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.6 m -64.77 -49.59 70.16 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.564 0.746 . . . . 0.0 111.131 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -72.16 -26.82 62.24 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -172.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.06 -53.32 58.62 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.44 1.018 . . . . 0.0 110.767 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -66.47 -36.56 83.07 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.286 0.634 . . . . 0.0 112.502 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -59.69 -48.6 81.02 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.17 169.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.3 m -58.93 -41.51 87.52 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.538 0.735 . . . . 0.0 111.179 176.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.62 -40.4 88.76 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 175.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.7 96.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.339 -0.851 . . . . 0.0 111.533 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.34 -44.56 96.2 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.829 0.852 . . . . 0.0 111.704 174.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -59.81 -44.34 94.06 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 172.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 48.3 m -61.16 -44.04 97.94 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.819 0.736 . . . . 0.0 110.8 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.76 95.36 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.053 -1.029 . . . . 0.0 113.165 172.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.18 -33.94 77.2 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.016 0.926 . . . . 0.0 113.143 175.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -71.7 -33.16 68.55 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.654 1.182 . . . . 0.0 112.143 171.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -63.93 -43.74 94.96 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.888 -1.132 . . . . 0.0 111.14 169.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.33 -45.54 69.11 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.77 1.628 . . . . 0.0 111.255 169.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.32 -47.04 86.01 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.478 0.711 . . . . 0.0 112.394 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -59.11 -41.23 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.787 -1.196 . . . . 0.0 111.401 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.04 -42.32 97.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.439 0.696 . . . . 0.0 112.768 172.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -63.44 -35.08 79.24 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.603 1.161 . . . . 0.0 112.943 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.0 95.07 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -174.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.3 t -76.85 -23.08 52.71 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 98.6 mt -89.61 -36.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.64 1.176 . . . . 0.0 113.172 -176.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.0 p -84.34 -16.58 42.41 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.47 -0.01 76.95 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -142.59 149.25 49.92 Favored Pre-proline 0 N--CA 1.471 0.582 0 C-N-CA 126.438 1.895 . . . . 0.0 108.576 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -47.66 144.81 10.25 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.214 1.942 . . . . 0.0 111.077 168.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.5 m -109.39 175.12 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.773 0.829 . . . . 0.0 111.15 -178.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.38 165.69 30.95 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 115.408 0.923 . . . . 0.0 115.408 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.47 116.07 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 124.915 1.286 . . . . 0.0 107.955 177.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 34.5 t-80 -80.52 147.14 30.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 126.775 2.03 . . . . 0.0 111.243 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.9 142.18 30.65 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.706 1.602 . . . . 0.0 111.622 -179.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 24.1 p -132.94 177.0 7.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.782 1.633 . . . . 0.0 111.553 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -57.99 -14.72 7.0 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 170.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.9 m -137.06 -10.72 1.74 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -169.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.34 174.4 15.49 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.932 1.242 . . . . 0.0 112.602 179.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 12.4 p90 -142.07 156.06 45.39 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.409 1.484 . . . . 0.0 110.018 169.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -150.91 151.93 32.89 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.167 1.387 . . . . 0.0 110.64 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 6.0 mt -109.15 141.84 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.977 0.808 . . . . 0.0 109.606 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.1 mtp -134.74 149.98 50.51 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.421 1.088 . . . . 0.0 111.407 -175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.4 m -142.48 169.19 11.38 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 127.073 2.149 . . . . 0.0 111.372 -169.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -55.94 -36.37 95.65 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.476 2.784 . . . . 0.0 114.862 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 66.14 -42.38 0.16 Allowed Glycine 0 CA--C 1.541 1.659 0 C-N-CA 127.147 2.308 . . . . 0.0 117.037 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -143.84 -31.25 0.47 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -172.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.4 p -134.0 57.06 22.06 Favored Pre-proline 0 N--CA 1.485 1.289 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -169.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.24 -20.51 70.29 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 122.871 2.381 . . . . 0.0 114.547 -177.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -64.11 -8.94 13.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.322 1.449 . . . . 0.0 114.453 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -135.98 -128.53 0.15 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.262 1.825 . . . . 0.0 110.595 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -139.53 118.42 12.48 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.685 1.594 . . . . 0.0 109.894 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -152.53 159.5 43.29 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.36 1.464 . . . . 0.0 110.654 176.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 40.8 m95 -136.4 130.32 32.55 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.695 1.198 . . . . 0.0 112.239 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.2 t -142.38 138.0 16.08 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 126.748 2.019 . . . . 0.0 108.051 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -50.77 131.6 34.3 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.223 2.615 . . . . 0.0 112.81 170.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 29.4 tp -68.28 108.14 3.08 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.033 0.933 . . . . 0.0 111.02 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -138.61 -13.15 1.3 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -54.48 -29.04 48.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.604 1.562 . . . . 0.0 114.382 -172.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -142.28 27.06 1.77 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.178 1.791 . . . . 0.0 111.769 169.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -143.42 39.04 1.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.692 2.397 . . . . 0.0 109.541 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.13 -24.03 2.51 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 117.033 2.235 . . . . 0.0 117.033 -168.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -132.34 20.51 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.635 1.574 . . . . 0.0 112.031 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -132.39 4.3 3.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.384 1.474 . . . . 0.0 113.29 -170.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -34.86 41.15 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.157 1.783 . . . . 0.0 114.705 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -130.86 151.08 51.68 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.533 1.933 . . . . 0.0 111.277 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.09 158.64 43.88 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.078 1.351 . . . . 0.0 112.493 -169.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -158.18 58.68 0.46 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.89 2.076 . . . . 0.0 109.006 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 9.7 m0 -59.91 -24.34 64.23 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 117.02 2.23 . . . . 0.0 117.02 -169.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 166.06 20.16 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.731 1.15 . . . . 0.0 113.791 -177.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -137.4 15.14 2.98 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.45 1.1 . . . . 0.0 112.638 169.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.51 7.6 0.25 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.879 1.271 . . . . 0.0 113.817 -171.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.76 169.44 13.85 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.479 1.511 . . . . 0.0 112.03 -172.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -138.61 140.92 39.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.565 1.946 . . . . 0.0 109.024 169.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.8 143.97 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 125.339 1.456 . . . . 0.0 110.258 -173.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -137.52 152.82 49.89 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.614 1.966 . . . . 0.0 109.728 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.5 tt -151.16 146.23 25.97 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.868 0.867 . . . . 0.0 111.98 -170.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.3 pp0? -149.14 156.71 40.18 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 125.408 1.483 . . . . 0.0 110.517 169.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -77.2 -16.13 25.61 Favored 'Cis proline' 0 CA--C 1.541 0.843 0 CA-C-N 120.355 1.163 . . . . 0.0 114.128 -0.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -70.08 151.57 45.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.57 1.148 . . . . 0.0 113.418 -175.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -63.45 119.3 52.26 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.896 1.678 . . . . 0.0 112.582 178.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -80.29 64.85 8.92 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.137 3.225 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -145.92 157.3 43.9 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.262 1.425 . . . . 0.0 111.587 -174.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -66.7 75.46 0.11 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.826 1.65 . . . . 0.0 113.872 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.9 t -75.85 159.15 31.28 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.653 1.981 . . . . 0.0 113.146 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.16 -8.59 55.55 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.317 1.447 . . . . 0.0 113.085 169.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -134.41 163.97 47.33 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 125.825 1.65 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.34 145.16 37.97 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 121.549 1.5 . . . . 0.0 110.466 168.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -73.91 -53.24 10.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.227 1.011 . . . . 0.0 111.017 173.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.0 t -81.92 140.31 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.667 1.187 . . . . 0.0 109.496 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 53.7 t -130.91 142.9 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.959 0.903 . . . . 0.0 111.07 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.99 127.42 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 127.784 2.433 . . . . 0.0 108.736 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.3 mt -89.12 156.9 18.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.394 0.616 . . . . 0.0 111.307 170.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.2 -21.77 60.0 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -71.16 -20.27 62.32 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.976 1.71 . . . . 0.0 113.575 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.62 3.3 62.75 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.897 1.237 . . . . 0.0 114.775 -177.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.02 147.09 28.37 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 118.455 1.127 . . . . 0.0 108.663 169.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.1 mm -131.42 155.89 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 124.935 1.294 . . . . 0.0 110.241 -168.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.7 p -55.67 129.6 70.74 Favored Pre-proline 0 N--CA 1.471 0.587 0 O-C-N 121.273 -0.892 . . . . 0.0 110.224 169.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -71.89 119.88 6.49 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.186 1.924 . . . . 0.0 111.456 175.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.479 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 13.1 p90 -149.84 174.74 12.32 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.229 1.811 . . . . 0.0 111.337 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 94.7 p -137.53 151.62 48.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.683 0.754 . . . . 0.0 111.118 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -139.76 128.32 22.99 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.281 1.832 . . . . 0.0 108.48 -169.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -123.24 150.96 42.78 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.611 1.565 . . . . 0.0 110.275 -173.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.5 mtt -129.67 142.13 50.78 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.873 1.269 . . . . 0.0 109.614 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.5 143.65 41.8 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.02 1.328 . . . . 0.0 111.046 -177.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.19 122.09 15.28 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.683 0.674 . . . . 0.0 110.133 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.07 -23.32 65.38 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -176.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -97.5 -48.67 1.95 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.766 1.174 . . . . 0.0 113.037 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.3 m -66.87 -31.28 71.78 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 117.951 0.875 . . . . 0.0 112.046 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.68 30.63 61.59 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 123.998 0.809 . . . . 0.0 113.665 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -133.36 149.35 72.17 Favored Pre-proline 0 N--CA 1.474 0.729 0 C-N-CA 125.873 1.669 . . . . 0.0 111.218 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.17 152.03 83.57 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.173 2.582 . . . . 0.0 112.2 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.76 -45.87 1.17 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 126.082 1.753 . . . . 0.0 112.36 -169.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.4 tp -151.66 154.74 36.97 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.33 1.452 . . . . 0.0 109.275 -173.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -146.38 144.79 29.98 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 123.856 0.862 . . . . 0.0 109.628 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.5 mt -126.0 136.38 52.92 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.561 2.345 . . . . 0.0 108.168 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.99 126.93 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.399 1.08 . . . . 0.0 110.708 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.479 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 43.4 t -93.82 -44.31 8.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -172.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 20.4 m 54.18 -5.54 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 -173.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.65 -1.5 3.97 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.342 1.448 . . . . 0.0 116.001 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 6.2 t -156.67 156.18 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.858 1.829 . . . . 0.0 114.88 -172.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.5 t-105 -61.18 137.53 94.27 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 125.812 1.645 . . . . 0.0 114.937 175.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -94.69 174.58 13.72 Favored 'Cis proline' 0 CA--C 1.546 1.09 0 CA-C-N 120.048 1.053 . . . . 0.0 110.487 -11.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.29 145.72 55.42 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.625 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -96.9 127.56 42.99 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.092 1.757 . . . . 0.0 110.555 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -96.17 143.66 27.08 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.526 1.53 . . . . 0.0 112.252 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.1 t -147.35 151.96 37.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.582 1.553 . . . . 0.0 111.334 170.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.57 132.62 44.92 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.48 64.34 0.11 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.939 2.096 . . . . 0.0 115.732 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 0.0 OUTLIER 48.58 15.44 0.09 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 128.655 2.782 . . . . 0.0 117.891 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.25 -39.49 79.29 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.4 m -86.53 -15.05 41.21 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.51 1.124 . . . . 0.0 112.836 178.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 48.9 ttt-85 -66.98 138.02 94.91 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 120.991 -1.068 . . . . 0.0 112.237 -171.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 123.629 2.886 . . . . 0.0 113.137 168.648 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.4 mtm . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.309 0.1 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.22 -21.28 66.3 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 178.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 53.5 p90 -149.68 169.23 21.49 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.016 1.726 . . . . 0.0 111.412 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.14 -31.25 0.21 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 123.766 0.698 . . . . 0.0 114.712 177.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.1 mtp85 -73.83 6.34 3.35 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -53.72 -33.84 56.88 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -174.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.65 -36.15 78.21 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.311 -0.868 . . . . 0.0 112.6 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.3 t -73.55 -36.14 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.543 1.137 . . . . 0.0 110.584 173.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.86 70.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.605 1.162 . . . . 0.0 112.701 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.412 ' HA ' HD12 ' A' ' 121' ' ' LEU . 24.7 t-20 -57.83 -56.53 20.73 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.418 1.008 . . . . 0.0 112.418 169.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.4 m -58.9 -46.24 88.36 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.604 0.761 . . . . 0.0 111.297 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -65.96 -36.11 82.44 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 117.516 -1.231 . . . . 0.0 113.249 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.28 70.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.889 1.677 . . . . 0.0 110.978 171.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -61.89 -40.8 96.68 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.734 1.214 . . . . 0.0 111.973 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.7 tp10 -64.37 -50.19 68.65 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.265 1.426 . . . . 0.0 112.465 173.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 92.2 m -58.5 -37.17 75.02 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.173 1.389 . . . . 0.0 111.032 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.41 -44.93 70.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.666 1.187 . . . . 0.0 114.142 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.367 -0.833 . . . . 0.0 111.571 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -67.39 -39.42 85.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.736 0.815 . . . . 0.0 112.315 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.33 -39.85 92.06 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.094 0.861 . . . . 0.0 112.068 171.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.6 m -58.83 -42.09 88.44 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.57 -0.707 . . . . 0.0 110.827 174.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.21 -36.92 85.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.793 -1.192 . . . . 0.0 113.973 171.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.71 -32.91 73.88 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 120.774 -1.204 . . . . 0.0 113.321 174.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.9 tp -70.07 -34.73 73.56 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.192 -0.942 . . . . 0.0 111.637 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -62.6 -45.22 93.87 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.162 -0.961 . . . . 0.0 111.579 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.1 tp -53.98 -48.22 70.58 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.522 1.129 . . . . 0.0 111.542 170.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.14 -42.17 80.48 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 176.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.11 -45.19 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.195 -0.941 . . . . 0.0 111.123 172.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.42 -6.83 7.98 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.578 1.551 . . . . 0.0 113.884 174.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 57.4 mmt-85 -109.54 -31.36 7.53 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.932 1.293 . . . . 0.0 112.139 172.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.33 -33.49 74.79 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.037 1.289 . . . . 0.0 113.055 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 t -69.5 -15.34 63.23 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 173.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 67.7 mt -112.71 -30.9 6.92 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.554 1.542 . . . . 0.0 114.15 -173.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.6 m -77.59 -21.36 52.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -169.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.3 -5.19 60.53 Favored Glycine 0 CA--C 1.543 1.787 0 N-CA-C 115.284 0.874 . . . . 0.0 115.284 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -136.48 150.32 70.13 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 128.428 2.691 . . . . 0.0 106.566 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -45.9 151.49 1.38 Allowed 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.819 2.346 . . . . 0.0 112.815 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.4 t -113.49 160.25 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.224 1.41 . . . . 0.0 108.788 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.21 172.67 29.25 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 115.39 0.916 . . . . 0.0 115.39 -176.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.2 mt -134.77 113.99 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.902 1.281 . . . . 0.0 109.132 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -75.18 149.03 39.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.91 1.284 . . . . 0.0 110.008 169.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -136.8 139.35 41.71 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.326 1.45 . . . . 0.0 112.638 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.1 p -115.62 -175.49 2.73 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.248 1.819 . . . . 0.0 109.819 169.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.86 -10.37 37.52 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 173.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 94.5 p -146.15 -11.63 0.49 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -172.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -142.45 169.9 16.71 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.208 1.367 . . . . 0.0 112.47 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 35.6 p-90 -123.25 161.76 23.95 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.82 1.648 . . . . 0.0 110.323 171.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -146.71 121.7 10.04 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.176 1.39 . . . . 0.0 110.586 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.2 mm -80.94 138.39 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 95.0 mtp -137.69 144.36 41.75 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.153 0.981 . . . . 0.0 111.388 -171.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.7 m -140.61 166.31 23.95 Favored Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 127.478 2.311 . . . . 0.0 111.176 -169.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.62 167.61 9.69 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.0 2.467 . . . . 0.0 114.162 173.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.86 164.69 31.86 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.434 1.969 . . . . 0.0 110.256 169.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 85.1 tttt 59.38 -52.5 0.06 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 127.909 2.484 . . . . 0.0 115.469 -169.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 t -152.88 142.48 14.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 125.817 1.647 . . . . 0.0 112.208 -172.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -80.17 -16.65 10.92 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.435 2.757 . . . . 0.0 112.532 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 m -82.14 -5.89 58.78 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -169.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -146.95 150.33 34.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.891 1.276 . . . . 0.0 111.664 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -55.35 115.59 2.36 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.774 1.63 . . . . 0.0 112.088 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.3 tpt85 -153.29 154.47 34.67 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.519 1.528 . . . . 0.0 110.1 176.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -137.94 148.62 45.44 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.952 0.901 . . . . 0.0 112.823 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.4 t -150.79 144.44 17.26 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 129.633 3.173 . . . . 0.0 106.791 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -62.92 154.43 66.76 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 CA-C-N 121.795 1.677 . . . . 0.0 111.307 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.6 21.8 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -61.33 -10.22 6.73 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.02 -2.3 . . . . 0.0 114.023 177.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -65.92 -20.72 66.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.327 1.051 . . . . 0.0 113.061 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.87 -12.48 0.56 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -127.28 55.8 1.57 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.731 2.412 . . . . 0.0 108.091 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -39.88 -38.72 0.72 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 117.327 2.343 . . . . 0.0 117.327 -169.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -130.76 18.6 5.14 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.547 1.539 . . . . 0.0 112.033 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -136.85 1.51 2.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.786 1.635 . . . . 0.0 113.024 -170.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.1 p -60.85 -16.28 39.62 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.758 1.623 . . . . 0.0 115.08 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.94 138.92 39.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.357 1.463 . . . . 0.0 111.054 171.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -162.21 -179.99 7.47 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -142.97 166.2 25.29 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.769 2.428 . . . . 0.0 110.574 173.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -136.31 16.32 3.2 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -147.58 171.5 15.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.327 1.051 . . . . 0.0 113.168 -170.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -137.76 14.14 2.92 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.518 1.527 . . . . 0.0 111.715 169.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.47 11.55 0.79 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.979 1.712 . . . . 0.0 114.833 -172.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.4 mt -109.79 160.39 16.38 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.707 1.139 . . . . 0.0 112.879 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 64.5 m -134.79 124.41 25.11 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 127.229 2.212 . . . . 0.0 107.604 169.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -96.42 142.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.675 1.19 . . . . 0.0 109.983 -175.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -139.4 155.31 47.71 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.234 1.813 . . . . 0.0 109.74 175.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.0 mp -139.21 162.24 35.47 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.173 -0.954 . . . . 0.0 112.718 -177.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.17 145.87 14.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 126.144 1.778 . . . . 0.0 110.399 169.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -72.0 -9.58 15.84 Favored 'Cis proline' 0 CA--C 1.544 1.02 0 CA-C-N 120.575 1.241 . . . . 0.0 113.284 -8.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -64.22 173.6 1.92 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.816 1.647 . . . . 0.0 113.141 171.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -127.38 137.71 31.25 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.214 1.405 . . . . 0.0 111.191 -169.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -78.71 59.51 7.28 Favored 'Trans proline' 0 CA--C 1.549 1.254 0 C-N-CA 124.814 3.676 . . . . 0.0 112.097 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -151.43 148.04 27.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.936 1.294 . . . . 0.0 112.429 -173.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -77.85 82.61 4.22 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.352 1.072 . . . . 0.0 113.535 -177.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 64.1 p -68.02 8.6 0.39 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.147 2.179 . . . . 0.0 114.723 169.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.7 m120 60.77 21.39 11.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.664 1.986 . . . . 0.0 114.106 -175.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -145.98 168.26 12.17 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 126.891 2.076 . . . . 0.0 109.672 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.53 149.62 56.06 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 120.931 1.088 . . . . 0.0 111.388 169.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -77.46 -60.26 2.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.19 0.996 . . . . 0.0 109.883 170.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 41.0 t -84.42 142.13 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.278 1.431 . . . . 0.0 109.504 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 75.6 t -131.0 144.27 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 110.863 175.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -126.84 130.88 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.123 2.569 . . . . 0.0 109.342 -169.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.6 mt -94.13 157.05 16.25 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.428 0.632 . . . . 0.0 111.222 169.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.8 -24.36 56.9 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -71.49 -18.54 62.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.979 1.712 . . . . 0.0 113.468 176.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.72 6.0 62.57 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.575 1.083 . . . . 0.0 114.394 -175.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -84.35 142.4 30.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.416 1.108 . . . . 0.0 108.709 169.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -129.27 152.73 37.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 125.882 1.673 . . . . 0.0 110.12 -168.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.4 p -55.49 118.66 19.97 Favored Pre-proline 0 N--CA 1.471 0.6 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.259 169.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -68.42 126.46 14.24 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 121.946 1.764 . . . . 0.0 111.102 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -157.13 173.64 16.68 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.755 1.222 . . . . 0.0 112.951 -175.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -133.62 149.8 51.6 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.778 0.831 . . . . 0.0 111.053 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.1 tp -139.56 120.5 14.52 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.946 2.098 . . . . 0.0 108.364 -173.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -110.28 148.71 31.37 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.953 1.701 . . . . 0.0 110.455 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.6 mtt -126.38 134.29 51.08 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.294 1.438 . . . . 0.0 108.579 176.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -130.15 153.36 48.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.23 1.412 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.85 129.21 39.0 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.675 0.67 . . . . 0.0 110.022 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.56 -16.33 62.46 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -93.18 -53.86 1.82 Allowed Glycine 0 CA--C 1.533 1.189 0 C-N-CA 124.139 0.875 . . . . 0.0 113.101 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 63.1 p -79.03 -26.66 43.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.09 0.945 . . . . 0.0 113.283 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 76.8 3.73 80.52 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.885 1.231 . . . . 0.0 113.563 -169.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.65 131.36 61.19 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.767 1.284 . . . . 0.0 111.759 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.3 144.58 30.08 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.662 2.908 . . . . 0.0 114.273 172.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -121.71 -43.85 2.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.477 1.911 . . . . 0.0 112.071 -175.463 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -155.02 156.01 35.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.874 1.67 . . . . 0.0 108.876 -172.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.5 m -141.82 148.24 38.54 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.352 1.061 . . . . 0.0 109.426 171.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 37.0 mt -122.46 140.36 52.82 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.557 2.343 . . . . 0.0 107.64 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.2 t -143.56 130.1 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.71 0.804 . . . . 0.0 111.786 -169.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 36.0 t -117.22 115.12 24.69 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.206 1.403 . . . . 0.0 110.94 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -74.45 -10.01 59.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.447 1.099 . . . . 0.0 113.952 174.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 135.73 -0.65 3.42 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.949 1.262 . . . . 0.0 115.495 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 72.2 m -147.35 151.89 37.29 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.147 1.474 . . . . 0.0 113.301 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -60.34 135.58 91.4 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 125.469 1.508 . . . . 0.0 114.854 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -94.04 167.5 19.98 Favored 'Cis proline' 0 CA--C 1.545 1.073 0 CA-C-N 120.346 1.159 . . . . 0.0 110.398 -11.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . 0.258 0.1 OUTLIER -84.92 158.39 20.58 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.19 -0.944 . . . . 0.0 112.474 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -75.59 174.36 9.82 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.181 2.192 . . . . 0.0 113.78 -169.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -135.5 137.5 42.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.594 1.957 . . . . 0.0 110.34 169.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.8 t -152.93 162.91 40.72 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.897 1.279 . . . . 0.0 111.577 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -88.43 134.01 33.96 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.56 58.87 0.67 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.18 1.792 . . . . 0.0 115.086 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 62.54 11.06 4.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 127.209 2.204 . . . . 0.0 116.909 176.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.98 -29.47 63.28 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -169.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 81.3 p -91.92 -9.62 42.51 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.52 14.59 Favored Pre-proline 0 N--CA 1.478 0.95 0 CA-C-O 116.202 -1.856 . . . . 0.0 115.835 -174.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 C--O 1.25 1.113 0 C-N-CA 123.971 3.114 . . . . 0.0 115.18 176.776 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.791 0.329 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.25 161.82 38.64 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.153 1.381 . . . . 0.0 111.179 177.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -145.72 -2.29 0.75 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.876 1.27 . . . . 0.0 113.197 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.6 28.97 45.43 Favored Glycine 0 CA--C 1.535 1.301 0 O-C-N 121.089 -1.007 . . . . 0.0 112.037 -170.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.4 ttm-85 -144.87 -29.65 0.46 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.405 1.882 . . . . 0.0 112.815 -169.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -49.22 -39.79 31.26 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.271 2.228 . . . . 0.0 115.325 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.61 -39.76 80.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.865 0.757 . . . . 0.0 112.629 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.46 -41.68 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.754 0.822 . . . . 0.0 110.318 176.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -49.31 78.05 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.471 0.709 . . . . 0.0 111.903 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.24 -35.35 78.66 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.306 0.957 . . . . 0.0 112.666 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.4 m -61.95 -53.22 58.73 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.016 0.826 . . . . 0.0 111.219 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -61.17 -33.33 73.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.206 1.002 . . . . 0.0 112.885 177.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.2 90.18 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.379 1.072 . . . . 0.0 113.01 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.3 mtt-85 -63.93 -42.27 97.41 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.966 0.906 . . . . 0.0 110.841 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.8 -46.23 86.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.986 0.914 . . . . 0.0 112.26 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.1 m -59.69 -42.45 93.02 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.923 1.289 . . . . 0.0 111.252 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.71 77.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.346 1.058 . . . . 0.0 113.681 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.15 97.04 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.314 -0.866 . . . . 0.0 111.537 173.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 52.4 tpt85 -64.02 -39.33 93.85 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.324 1.05 . . . . 0.0 112.427 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.82 -43.32 93.48 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.47 1.108 . . . . 0.0 113.022 170.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.1 m -60.11 -43.17 95.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.228 0.611 . . . . 0.0 110.416 176.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.97 94.97 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.069 -1.019 . . . . 0.0 113.49 171.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.7 -36.38 83.46 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.181 -0.949 . . . . 0.0 113.246 176.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.6 tp -71.45 -33.64 69.53 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.418 1.087 . . . . 0.0 111.603 174.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.02 -44.46 96.67 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.055 -1.028 . . . . 0.0 111.334 169.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -45.26 62.78 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.467 1.507 . . . . 0.0 111.74 169.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.7 -45.18 87.7 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 176.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 59.8 mt -61.65 -45.21 99.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.526 1.131 . . . . 0.0 110.831 177.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.02 -27.94 69.23 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.649 1.18 . . . . 0.0 113.271 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -92.78 -30.27 15.57 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.08 -29.92 67.69 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.2 t -77.72 -14.64 59.55 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 173.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.3 mt -106.14 -37.14 6.69 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.302 1.441 . . . . 0.0 113.651 -172.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.4 m -85.6 -7.91 58.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -173.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.17 -1.87 88.48 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 115.384 0.914 . . . . 0.0 115.384 170.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -142.15 148.36 47.87 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 127.167 2.187 . . . . 0.0 107.843 171.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -44.63 152.6 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.721 2.947 . . . . 0.0 113.942 168.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.26 161.84 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.673 1.589 . . . . 0.0 108.105 175.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.14 173.07 34.08 Favored Glycine 0 N--CA 1.465 0.615 0 CA-C-N 120.118 1.326 . . . . 0.0 115.473 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.9 mt -136.62 123.48 31.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 C-N-CA 124.583 1.153 . . . . 0.0 109.18 -177.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -88.92 151.73 22.15 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.882 1.673 . . . . 0.0 110.605 171.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -141.14 144.73 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.179 1.392 . . . . 0.0 112.676 -173.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.4 p -128.03 179.69 5.44 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.772 1.629 . . . . 0.0 110.589 170.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.7 1.45 12.29 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 121.313 -0.867 . . . . 0.0 113.254 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -138.27 -21.21 1.06 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -173.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.33 175.82 12.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.061 1.345 . . . . 0.0 112.144 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 26.7 p90 -139.0 147.8 42.62 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 126.006 1.722 . . . . 0.0 109.069 175.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -141.65 113.59 7.94 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.233 1.413 . . . . 0.0 111.284 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.0 mt -78.57 137.53 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 24.1 mtm -134.07 155.27 50.32 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.977 1.311 . . . . 0.0 110.885 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.4 p -147.18 161.76 35.3 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.654 1.182 . . . . 0.0 110.956 -168.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -59.72 144.03 99.52 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.627 2.218 . . . . 0.0 112.567 169.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -131.44 -13.67 1.85 Allowed Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.574 1.083 . . . . 0.0 115.24 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -158.21 153.45 25.69 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.298 2.239 . . . . 0.0 108.803 174.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . 0.261 15.3 t 33.4 68.06 1.05 Allowed Pre-proline 0 N--CA 1.483 1.196 0 C-N-CA 126.457 1.903 . . . . 0.0 115.999 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -52.41 -24.68 22.32 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.09 2.527 . . . . 0.0 113.949 170.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -57.12 -14.86 4.38 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.879 2.072 . . . . 0.0 115.141 171.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.28 -108.91 0.26 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.374 1.469 . . . . 0.0 111.263 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -154.05 119.59 5.19 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.236 1.414 . . . . 0.0 110.731 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.1 tpt85 -153.52 153.23 32.02 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.505 1.522 . . . . 0.0 110.384 173.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -136.42 147.06 47.07 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.453 1.101 . . . . 0.0 111.486 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -149.04 144.15 17.77 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 126.944 2.098 . . . . 0.0 108.363 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.66 131.75 42.8 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 122.745 2.296 . . . . 0.0 112.683 171.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.9 tp -67.54 99.06 0.72 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.853 1.261 . . . . 0.0 111.098 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -139.97 -7.08 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -171.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.84 -27.59 52.26 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.651 1.18 . . . . 0.0 114.142 -173.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -139.46 31.0 2.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.975 1.71 . . . . 0.0 110.897 169.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -148.61 45.15 1.03 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.849 2.46 . . . . 0.0 109.082 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.2 123.06 8.69 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.956 1.303 . . . . 0.0 112.937 -169.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.1 t70 57.66 11.21 1.22 Allowed 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 -177.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -123.32 26.98 7.7 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.408 -1.432 . . . . 0.0 113.784 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.9 p -62.66 -40.01 95.71 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.093 0.957 . . . . 0.0 112.434 169.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.16 139.96 30.62 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.333 1.053 . . . . 0.0 110.707 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -138.96 157.76 45.43 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -169.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -156.76 53.36 0.52 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.776 2.03 . . . . 0.0 110.037 -169.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 15.8 m0 -60.78 18.3 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.619 2.768 . . . . 0.0 118.358 -169.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -144.91 179.37 7.38 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.375 -1.453 . . . . 0.0 113.671 -173.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -137.23 16.82 2.98 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.51 1.524 . . . . 0.0 112.852 175.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.67 -1.26 0.7 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.8 mt -119.64 163.53 17.24 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.967 1.365 . . . . 0.0 114.436 -169.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.0 t -136.29 129.31 31.27 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 128.237 2.615 . . . . 0.0 106.949 168.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.83 137.59 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.648 1.179 . . . . 0.0 109.61 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -133.24 132.01 40.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.916 1.286 . . . . 0.0 109.58 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -116.85 145.23 43.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.691 1.196 . . . . 0.0 111.846 -169.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -145.45 151.41 47.14 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.476 1.91 . . . . 0.0 110.495 -172.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -75.92 -15.33 24.31 Favored 'Cis proline' 0 CA--C 1.543 0.953 0 CA-C-N 120.244 1.123 . . . . 0.0 112.337 -10.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -64.63 133.82 53.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.652 . . . . 0.0 111.868 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.14 147.51 90.62 Favored Pre-proline 0 CA--C 1.547 0.833 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 176.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -71.42 142.28 40.49 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.723 2.282 . . . . 0.0 109.588 169.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -154.99 -159.21 0.92 Allowed 'General case' 0 CA--C 1.549 0.936 0 O-C-N 121.507 -0.745 . . . . 0.0 112.221 -171.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -143.07 41.79 1.53 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.485 2.714 . . . . 0.0 108.106 168.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 34.9 t -65.9 154.49 39.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.764 2.026 . . . . 0.0 114.214 -169.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -69.98 -9.37 54.95 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 113.316 169.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -126.06 161.13 53.48 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 125.046 1.339 . . . . 0.0 111.548 176.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.51 158.62 43.88 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.376 2.051 . . . . 0.0 112.062 169.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -87.94 -28.93 21.19 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.692 0.797 . . . . 0.0 111.061 169.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -113.21 134.74 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.994 1.317 . . . . 0.0 109.826 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 87.6 t -133.0 140.79 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.408 1.083 . . . . 0.0 110.775 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -118.7 120.23 63.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 127.304 2.241 . . . . 0.0 108.652 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.5 mt -89.21 158.65 17.8 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.129 0.966 . . . . 0.0 111.742 176.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.17 -23.0 53.78 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -106.77 7.39 30.31 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.726 1.211 . . . . 0.0 113.932 -172.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 100.01 12.4 39.96 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 115.559 0.984 . . . . 0.0 115.559 172.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.54 ' C ' HD12 ' A' ' 105' ' ' ILE . 10.7 pt20 -98.78 140.34 33.11 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.614 1.207 . . . . 0.0 109.848 169.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.54 HD12 ' C ' ' A' ' 104' ' ' GLN . 2.9 mp -133.76 143.83 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.757 1.623 . . . . 0.0 108.068 -169.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 p -50.16 123.15 15.81 Favored Pre-proline 0 N--CA 1.475 0.779 0 C-N-CA 124.328 1.051 . . . . 0.0 111.613 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.76 123.5 13.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.675 2.25 . . . . 0.0 112.929 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.472 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.2 p90 -152.21 174.24 14.0 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.388 1.475 . . . . 0.0 111.36 176.164 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 65.7 m -145.94 146.57 31.1 Favored 'General case' 0 C--N 1.33 -0.251 0 O-C-N 121.307 -0.871 . . . . 0.0 111.373 172.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.2 tp -129.2 124.47 34.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 127.641 2.377 . . . . 0.0 108.392 -169.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -120.19 144.86 47.48 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.492 1.117 . . . . 0.0 110.118 -177.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.1 mtt -123.06 129.99 52.2 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 109.629 -178.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.11 138.68 52.62 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.187 1.395 . . . . 0.0 111.088 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -57.92 123.62 16.43 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.989 1.316 . . . . 0.0 111.535 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -17.81 54.92 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -116.82 -45.03 0.56 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.09 1.329 . . . . 0.0 113.943 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.0 m -73.3 -25.65 60.74 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.679 1.239 . . . . 0.0 112.338 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.9 33.35 57.68 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.022 0.82 . . . . 0.0 113.984 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -136.71 139.59 29.55 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.287 1.435 . . . . 0.0 111.375 -169.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -52.14 146.57 30.19 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.942 3.095 . . . . 0.0 114.626 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.07 -8.71 1.02 Allowed 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.0 tp -163.07 152.71 15.42 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.42 1.488 . . . . 0.0 110.308 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 1.1 m -139.71 146.24 39.35 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.642 1.577 . . . . 0.0 108.781 169.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.59 139.17 53.82 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.745 2.418 . . . . 0.0 108.829 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.9 t -137.01 128.44 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.46 0.704 . . . . 0.0 112.328 -170.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.472 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 52.7 t -105.64 109.41 21.36 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.305 1.442 . . . . 0.0 109.977 172.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 63.7 p -74.04 -17.35 60.98 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 143.58 -8.12 2.03 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.068 1.318 . . . . 0.0 115.034 -177.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.5 p -153.99 161.05 42.25 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.214 1.507 . . . . 0.0 113.899 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -61.73 137.89 95.19 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 125.95 1.7 . . . . 0.0 115.533 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -94.64 177.67 10.75 Favored 'Cis proline' 0 CA--C 1.547 1.157 0 CA-C-N 120.032 1.047 . . . . 0.0 110.513 -11.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.32 153.88 41.48 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.073 -1.017 . . . . 0.0 111.757 171.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -88.26 161.39 17.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.372 1.469 . . . . 0.0 109.505 169.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -138.26 140.63 39.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.621 1.568 . . . . 0.0 111.247 -169.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 2.4 t -150.36 157.46 43.07 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.81 2.044 . . . . 0.0 109.703 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -82.57 -12.31 57.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -169.56 65.94 0.05 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.152 1.381 . . . . 0.0 114.044 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.07 12.31 2.37 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 116.904 2.187 . . . . 0.0 116.904 171.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.23 -28.9 69.49 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 120.715 1.598 . . . . 0.0 113.822 -177.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 36.0 p -89.18 3.37 52.15 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.059 1.744 . . . . 0.0 113.743 175.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -115.85 85.15 14.05 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 125.99 1.716 . . . . 0.0 111.399 -170.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--O 1.25 1.091 0 C-N-CA 123.07 2.514 . . . . 0.0 112.093 172.099 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mtp . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.66 12.7 1.54 Allowed 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.0 p90 -154.47 177.84 10.73 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.765 1.626 . . . . 0.0 112.054 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 104.72 8.46 37.19 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.98 1.276 . . . . 0.0 114.456 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 30.2 ptt-85 -150.93 52.68 0.86 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.848 2.059 . . . . 0.0 111.414 -170.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -50.85 -35.25 31.52 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.978 1.311 . . . . 0.0 114.073 -173.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.49 -33.8 75.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 39.0 t -73.58 -44.08 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.843 0.857 . . . . 0.0 110.199 175.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.55 95.75 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 118.772 0.714 . . . . 0.0 111.904 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -56.58 -48.85 76.48 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.072 1.349 . . . . 0.0 112.509 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 176.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -59.09 -40.98 86.96 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.262 -0.875 . . . . 0.0 112.66 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.67 83.69 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.955 1.252 . . . . 0.0 111.886 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -68.32 -39.38 82.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.454 1.102 . . . . 0.0 111.457 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.57 -44.57 90.28 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.121 0.568 . . . . 0.0 112.219 171.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.1 m -60.08 -38.63 83.47 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.866 1.267 . . . . 0.0 111.589 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -44.25 81.0 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 173.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.5 98.64 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 121.349 -0.844 . . . . 0.0 112.034 174.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -60.84 -47.72 85.07 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.834 1.254 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -58.59 -43.39 89.49 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 174.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -57.84 -43.01 85.58 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.06 0.845 . . . . 0.0 111.021 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.32 89.33 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.882 -1.136 . . . . 0.0 113.722 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.84 -31.2 71.66 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.972 -1.08 . . . . 0.0 113.46 176.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 tp -70.23 -35.98 74.22 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.376 1.07 . . . . 0.0 111.498 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.43 -44.73 95.72 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.12 -0.987 . . . . 0.0 111.653 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 tp -53.67 -48.1 69.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.614 1.166 . . . . 0.0 111.393 169.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.84 -38.48 85.63 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.9 mt -64.95 -46.21 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.953 0.901 . . . . 0.0 110.935 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.81 -40.89 89.89 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.8 -0.563 . . . . 0.0 112.115 175.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -67.31 -41.61 85.06 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.464 -0.772 . . . . 0.0 112.398 173.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.07 -38.11 87.57 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.948 1.249 . . . . 0.0 112.605 176.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.38 -24.19 50.63 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.959 -0.463 . . . . 0.0 112.17 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -32.92 17.71 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.08 0.952 . . . . 0.0 113.122 177.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.9 m -79.99 -21.45 43.62 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -169.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.54 8.5 87.61 Favored Glycine 0 CA--C 1.541 1.709 0 CA-C-N 118.82 0.736 . . . . 0.0 114.616 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -144.99 149.06 41.03 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 127.584 2.354 . . . . 0.0 107.595 171.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.06 160.3 0.29 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.485 2.79 . . . . 0.0 113.719 168.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.1 t -127.56 162.24 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 126.629 1.971 . . . . 0.0 109.099 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.58 178.64 28.78 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 115.216 0.846 . . . . 0.0 115.216 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -133.59 116.63 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.793 1.237 . . . . 0.0 109.358 -172.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -85.36 68.46 10.48 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.877 2.071 . . . . 0.0 110.851 -176.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -61.65 153.1 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.716 0.806 . . . . 0.0 113.075 169.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 p -139.37 -177.05 4.75 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.308 2.243 . . . . 0.0 109.77 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -57.76 -21.98 44.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 173.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m -138.39 -4.08 1.68 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -171.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.42 176.17 10.24 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 122.361 1.077 . . . . 0.0 113.409 -176.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -154.55 161.58 41.56 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.821 2.448 . . . . 0.0 108.49 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.7 148.33 1.12 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.741 2.016 . . . . 0.0 109.879 169.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.6 mm -73.29 147.23 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.058 0.543 . . . . 0.0 109.756 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 61.6 mtp -128.65 134.58 48.57 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.094 1.358 . . . . 0.0 108.804 169.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -134.71 160.04 69.91 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 125.39 1.476 . . . . 0.0 109.878 -168.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -63.39 -24.78 71.13 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.25 1.967 . . . . 0.0 115.135 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.91 -52.76 0.05 OUTLIER Glycine 0 CA--C 1.54 1.608 0 C-N-CA 129.219 3.295 . . . . 0.0 116.738 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -144.03 -18.11 0.58 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 128.164 2.586 . . . . 0.0 112.689 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 p -131.1 69.59 82.41 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 125.099 1.36 . . . . 0.0 113.161 -169.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -71.0 27.77 0.21 Allowed 'Trans proline' 0 CA--C 1.55 1.305 0 C-N-CA 124.974 3.783 . . . . 0.0 113.763 173.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 m -71.14 -35.19 71.6 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.073 1.749 . . . . 0.0 113.932 -170.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -173.22 -44.55 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.631 1.572 . . . . 0.0 112.98 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -148.53 -66.76 0.23 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.174 0.99 . . . . 0.0 112.67 -172.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -12.41 87.73 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 129.226 3.01 . . . . 0.0 115.547 -172.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -73.69 161.03 30.71 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 36.0 t -139.72 134.48 16.12 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 128.022 2.529 . . . . 0.0 107.205 170.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -65.04 133.58 36.25 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.049 1.833 . . . . 0.0 110.167 174.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -76.46 82.02 3.17 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.802 0.811 . . . . 0.0 111.075 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -132.21 17.82 4.5 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.325 1.85 . . . . 0.0 112.584 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -58.66 -24.04 60.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.746 1.218 . . . . 0.0 114.088 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -145.43 -33.31 0.36 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.731 1.613 . . . . 0.0 112.36 173.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.9 28.36 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.989 1.715 . . . . 0.0 113.922 169.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.6 -25.55 10.96 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.617 1.967 . . . . 0.0 116.101 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -132.05 18.41 4.55 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.063 1.745 . . . . 0.0 112.603 175.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -136.86 -2.01 2.16 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.505 1.522 . . . . 0.0 113.617 -173.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 79.7 p -65.12 -14.32 60.26 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -176.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -135.11 162.25 33.02 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.752 1.221 . . . . 0.0 113.997 -172.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.289 48.2 t-20 40.75 -114.57 0.21 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.945 2.098 . . . . 0.0 113.434 -168.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.5 t70 56.34 8.07 0.39 Allowed 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 125.906 1.683 . . . . 0.0 114.825 -169.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 49.8 m0 -115.42 -33.76 5.16 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.621 -1.3 . . . . 0.0 112.935 -170.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 169.07 23.32 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -142.03 25.5 1.93 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.987 1.715 . . . . 0.0 111.097 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -143.33 -1.62 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -169.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 52.0 mt -117.06 165.24 13.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -169.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -133.94 131.43 39.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 128.794 2.838 . . . . 0.0 107.341 169.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -103.37 142.47 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 124.817 1.247 . . . . 0.0 109.468 -174.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -139.24 149.38 44.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.581 1.552 . . . . 0.0 109.547 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 83.9 mt -132.42 160.46 36.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.014 0.925 . . . . 0.0 112.727 -171.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.55 142.83 13.11 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.823 1.649 . . . . 0.0 110.029 169.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -73.19 -8.28 18.15 Favored 'Cis proline' 0 CA--C 1.547 1.155 0 CA-C-N 120.419 1.185 . . . . 0.0 113.516 -9.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -64.48 173.68 2.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.133 1.773 . . . . 0.0 112.891 174.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -118.16 134.39 23.36 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.228 1.411 . . . . 0.0 112.224 -175.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -78.59 74.25 5.53 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 124.123 3.215 . . . . 0.0 111.256 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -136.42 144.87 44.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.573 1.149 . . . . 0.0 111.567 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -76.34 56.17 1.05 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.351 1.461 . . . . 0.0 111.627 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.7 p -65.51 -6.46 10.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 128.479 2.712 . . . . 0.0 117.083 -169.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.68 26.08 15.84 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 113.97 -170.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -142.66 165.59 25.78 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 125.546 1.538 . . . . 0.0 109.775 169.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.96 142.74 69.91 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 121.437 1.425 . . . . 0.0 113.226 171.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.31 -13.22 18.91 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.851 2.061 . . . . 0.0 112.297 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -133.36 141.16 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.154 1.782 . . . . 0.0 108.019 173.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.4 t -133.18 144.26 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.487 1.115 . . . . 0.0 110.815 -174.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -130.2 121.16 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 127.948 2.499 . . . . 0.0 108.934 -169.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.5 157.81 31.8 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.988 1.315 . . . . 0.0 111.236 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.79 -7.81 5.69 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -178.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -115.56 8.31 15.09 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.724 1.61 . . . . 0.0 112.989 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.35 8.96 67.66 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 115.321 0.888 . . . . 0.0 115.321 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -78.84 144.4 35.05 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 169.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.3 mm -130.79 126.8 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.289 1.036 . . . . 0.0 108.763 -169.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 79.1 m -57.71 113.16 5.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -178.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -50.74 133.55 39.27 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 124.174 3.25 . . . . 0.0 115.839 -170.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.408 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.9 p90 -165.23 176.69 8.19 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.761 2.025 . . . . 0.0 111.4 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.0 t -141.15 146.15 36.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.633 1.173 . . . . 0.0 109.216 168.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tp -131.11 120.78 23.86 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 126.72 2.008 . . . . 0.0 108.704 -169.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.5 tt -112.11 148.34 34.17 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.485 1.514 . . . . 0.0 110.047 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 70.5 mtm -132.12 137.73 47.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.349 1.06 . . . . 0.0 109.372 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.42 155.89 49.82 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.94 1.696 . . . . 0.0 110.184 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -63.3 132.75 52.61 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 119.009 0.822 . . . . 0.0 110.327 173.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.21 -33.07 67.14 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -175.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.36 -47.44 3.79 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 119.016 0.825 . . . . 0.0 114.314 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.5 p -80.35 -28.05 38.17 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.81 7.57 70.33 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.887 0.756 . . . . 0.0 112.939 -169.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -71.15 128.22 90.65 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.969 1.307 . . . . 0.0 110.494 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.51 149.49 87.66 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.544 2.163 . . . . 0.0 112.008 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.25 -47.95 1.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.808 1.643 . . . . 0.0 111.884 -172.228 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.46 HD23 ' N ' ' A' ' 123' ' ' THR . 5.3 tt -153.31 149.0 27.43 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.391 1.476 . . . . 0.0 108.799 -169.524 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.46 ' N ' HD23 ' A' ' 122' ' ' LEU . 8.0 m -139.88 143.62 36.79 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.964 0.906 . . . . 0.0 110.085 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.3 mt -122.78 148.0 45.87 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 127.047 2.139 . . . . 0.0 108.675 -178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.7 t -142.84 135.86 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.284 0.634 . . . . 0.0 111.788 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.408 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 30.7 t -113.83 151.57 31.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.925 1.29 . . . . 0.0 111.581 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -128.64 -0.44 5.49 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.758 1.623 . . . . 0.0 113.787 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.24 -13.1 5.21 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.819 1.199 . . . . 0.0 115.381 176.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.6 t -153.04 156.07 38.06 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.478 1.639 . . . . 0.0 113.48 -174.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -55.98 137.99 72.46 Favored Pre-proline 0 CA--C 1.552 1.047 0 C-N-CA 126.738 2.015 . . . . 0.0 115.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -96.17 178.39 8.69 Favored 'Cis proline' 0 CA--C 1.55 1.283 0 CA-C-N 120.099 1.071 . . . . 0.0 110.793 -11.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.03 159.61 30.43 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.041 -1.037 . . . . 0.0 112.159 169.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -90.8 168.43 11.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.881 1.672 . . . . 0.0 109.902 169.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.455 ' HG3' HD21 ' A' ' 122' ' ' LEU . 56.1 tt0 -143.79 141.88 30.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.254 1.821 . . . . 0.0 111.847 -169.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.2 t -153.72 162.8 40.93 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.275 1.43 . . . . 0.0 111.116 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -84.75 137.12 33.39 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.593 -0.692 . . . . 0.0 109.155 170.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 23.87 65.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 127.556 2.342 . . . . 0.0 116.317 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 58.3 mtm180 57.25 9.67 0.74 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 118.043 2.608 . . . . 0.0 118.043 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -56.78 -20.73 23.94 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.467 1.485 . . . . 0.0 114.948 -175.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.83 12.29 6.23 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.596 1.558 . . . . 0.0 113.052 175.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -74.74 135.27 74.78 Favored Pre-proline 0 N--CA 1.482 1.128 0 O-C-N 120.442 -1.412 . . . . 0.0 110.032 176.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 C--O 1.249 1.069 0 C-N-CA 122.935 2.423 . . . . 0.0 113.318 171.188 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 110.512 -0.181 . . . . 0.0 110.512 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.31 166.49 29.83 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.972 1.309 . . . . 0.0 111.965 178.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.4 p90 -63.04 -28.85 70.38 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.946 1.298 . . . . 0.0 113.988 176.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 167.54 -178.79 41.36 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.17 1.367 . . . . 0.0 112.435 -175.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -145.29 136.02 24.46 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.209 1.403 . . . . 0.0 111.435 176.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -80.39 -26.91 38.31 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -171.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -67.8 -45.51 74.59 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.889 0.875 . . . . 0.0 112.602 -176.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.8 t -63.59 -46.03 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.564 0.745 . . . . 0.0 110.44 173.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.06 78.99 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.481 0.582 . . . . 0.0 112.329 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.75 -42.85 97.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.279 0.945 . . . . 0.0 111.992 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -60.62 -46.95 88.35 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.601 1.091 . . . . 0.0 111.402 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -61.31 -36.07 79.12 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.303 -0.856 . . . . 0.0 112.474 172.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.5 88.19 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.68 1.127 . . . . 0.0 112.763 175.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -61.74 -41.28 97.44 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.497 0.719 . . . . 0.0 111.271 178.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -64.73 -52.74 55.5 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.018 0.527 . . . . 0.0 111.945 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.5 m -52.82 -41.02 63.81 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.382 1.473 . . . . 0.0 111.559 177.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.72 -48.22 69.9 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.711 1.205 . . . . 0.0 113.593 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.93 -42.46 94.01 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.663 0.665 . . . . 0.0 112.34 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -68.52 -38.01 80.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.165 0.586 . . . . 0.0 111.226 175.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -58.71 -43.85 90.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.055 -0.974 . . . . 0.0 112.724 172.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -44.31 83.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.642 1.564 . . . . 0.0 111.988 173.067 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.05 -39.7 94.65 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.349 0.977 . . . . 0.0 113.099 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.96 78.57 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.089 0.956 . . . . 0.0 113.25 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.54 -36.9 71.14 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 0.0 111.359 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.52 -44.27 96.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.963 -1.085 . . . . 0.0 111.533 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.0 tp -53.07 -45.92 68.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.198 1.399 . . . . 0.0 111.419 169.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.23 -42.04 98.95 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 176.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 75.2 mt -61.89 -47.14 94.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.877 0.871 . . . . 0.0 110.528 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.82 -34.08 75.3 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.867 0.867 . . . . 0.0 113.019 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.0 ttt85 -79.05 -35.05 43.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.667 0.787 . . . . 0.0 113.023 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.34 -25.1 67.71 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -176.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.0 t -77.55 -14.29 59.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 171.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 76.8 mt -108.01 -30.88 8.21 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.009 1.723 . . . . 0.0 113.09 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.8 p -69.23 -29.79 67.81 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.548 1.939 . . . . 0.0 115.088 -176.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.99 83.04 Favored Glycine 0 CA--C 1.542 1.729 0 C-N-CA 124.895 1.236 . . . . 0.0 114.875 -176.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -145.42 145.76 27.45 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 127.247 2.219 . . . . 0.0 107.985 171.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -40.73 139.01 1.38 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.275 2.65 . . . . 0.0 112.955 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.5 t -91.13 162.7 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.47 1.508 . . . . 0.0 108.786 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -146.82 169.41 27.95 Favored Glycine 0 CA--C 1.521 0.447 0 O-C-N 120.914 -1.116 . . . . 0.0 114.637 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.7 mt -136.06 116.6 18.08 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 125.001 1.32 . . . . 0.0 107.5 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -78.6 153.61 30.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.958 1.303 . . . . 0.0 110.688 170.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -141.2 142.54 33.98 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.254 1.822 . . . . 0.0 111.303 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 t -144.34 175.53 10.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.997 1.719 . . . . 0.0 111.26 -176.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -49.07 -29.77 5.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.501 1.921 . . . . 0.0 115.816 -169.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 82.4 p -140.97 14.62 2.27 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.023 1.329 . . . . 0.0 113.586 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.08 171.66 17.52 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.759 1.266 . . . . 0.0 114.355 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -138.28 160.26 39.93 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 127.771 2.428 . . . . 0.0 107.868 169.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -154.19 125.5 7.42 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.797 1.239 . . . . 0.0 110.885 -176.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 16.9 mm -72.82 142.42 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.207 -178.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -137.15 151.2 48.54 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.801 1.241 . . . . 0.0 112.25 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -145.45 167.94 13.18 Favored Pre-proline 0 N--CA 1.478 0.948 0 C-N-CA 126.248 1.819 . . . . 0.0 111.277 -169.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -60.79 -23.82 77.46 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.184 2.589 . . . . 0.0 115.866 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.12 -145.32 49.05 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 121.631 -0.668 . . . . 0.0 111.858 -169.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -73.21 1.15 9.88 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 116.635 2.087 . . . . 0.0 116.635 -174.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.6 p -125.47 38.73 0.42 Allowed Pre-proline 0 N--CA 1.485 1.309 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -61.56 -15.07 39.1 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.098 2.532 . . . . 0.0 115.282 -169.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -60.88 -15.21 28.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.455 1.502 . . . . 0.0 114.45 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -145.03 166.91 23.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.901 1.68 . . . . 0.0 111.9 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -63.62 117.91 7.48 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.052 0.941 . . . . 0.0 111.897 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -154.05 160.11 41.85 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.651 1.58 . . . . 0.0 110.528 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -139.79 142.92 36.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.665 1.186 . . . . 0.0 112.52 174.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -150.83 145.14 17.92 Favored Pre-proline 0 N--CA 1.47 0.561 0 C-N-CA 126.099 1.759 . . . . 0.0 109.126 169.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.22 147.18 36.51 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.511 2.141 . . . . 0.0 111.794 169.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.68 12.72 0.12 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -178.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -61.62 -18.41 59.33 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.175 -1.578 . . . . 0.0 113.698 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.44 -18.85 65.64 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -145.83 -16.07 0.47 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -120.43 13.58 11.84 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.04 1.336 . . . . 0.0 112.264 169.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 53.41 -168.64 0.06 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.636 2.375 . . . . 0.0 114.443 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -55.47 -16.6 3.92 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.291 -1.505 . . . . 0.0 113.967 173.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.35 3.15 9.57 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.754 2.021 . . . . 0.0 113.858 174.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -62.54 16.74 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.793 2.037 . . . . 0.0 115.367 174.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -146.73 175.18 10.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.005 1.722 . . . . 0.0 114.305 -169.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -51.48 134.2 29.18 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -173.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -150.87 16.67 0.77 Allowed 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 127.116 2.166 . . . . 0.0 111.44 169.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -88.83 -9.36 51.99 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 -169.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.7 171.79 13.58 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -136.53 9.52 3.15 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.374 1.87 . . . . 0.0 112.301 175.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -157.15 15.8 0.27 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -169.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 68.7 mt -110.66 152.96 25.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.251 -1.531 . . . . 0.0 114.102 -177.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.7 t -131.23 134.94 46.93 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.769 2.827 . . . . 0.0 106.779 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -112.12 139.07 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 125.311 1.445 . . . . 0.0 110.323 -169.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -139.14 123.31 18.0 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.163 1.385 . . . . 0.0 110.747 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.8 mp -106.25 157.22 17.75 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.33 1.062 . . . . 0.0 112.739 -177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.92 126.66 7.27 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.775 2.03 . . . . 0.0 108.846 -174.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -75.99 -9.28 27.14 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.333 1.155 . . . . 0.0 113.605 -8.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -70.29 152.15 44.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.248 1.419 . . . . 0.0 113.972 -170.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.54 120.94 80.51 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.249 1.42 . . . . 0.0 113.453 179.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -79.68 63.12 8.7 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.3 3.333 . . . . 0.0 111.098 170.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -157.86 154.19 27.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.0 1.72 . . . . 0.0 110.515 -174.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -56.26 66.18 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.837 2.855 . . . . 0.0 116.925 -173.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.9 t -62.9 158.33 19.35 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.851 2.06 . . . . 0.0 113.479 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -71.07 -7.01 43.52 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.168 1.387 . . . . 0.0 113.46 171.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -136.44 161.76 60.25 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.748 1.619 . . . . 0.0 111.449 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.71 142.86 44.76 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 121.628 1.552 . . . . 0.0 110.17 168.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -72.44 -22.55 61.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.471 1.109 . . . . 0.0 112.31 174.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.5 t -123.17 135.46 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.031 1.333 . . . . 0.0 109.989 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 91.9 t -131.03 144.14 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.584 1.154 . . . . 0.0 110.526 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.3 mp -128.54 123.53 59.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 127.5 2.32 . . . . 0.0 110.184 -169.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.8 mt -83.16 160.82 21.75 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.082 0.944 . . . . 0.0 112.368 175.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.14 62.81 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.899 1.279 . . . . 0.0 113.604 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -93.72 16.17 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.201 1.801 . . . . 0.0 112.555 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 68.97 11.62 63.67 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.658 -1.276 . . . . 0.0 115.279 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.69 143.66 34.4 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.7 mm -132.84 143.41 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.193 1.397 . . . . 0.0 108.847 -171.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.1 p -53.07 127.84 46.83 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.252 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.63 127.55 12.53 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.356 2.038 . . . . 0.0 111.344 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.53 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.2 p90 -160.31 173.76 15.2 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.236 2.214 . . . . 0.0 110.433 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.2 m -135.2 145.88 48.13 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.69 0.796 . . . . 0.0 110.894 169.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -135.52 113.8 11.47 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.692 1.997 . . . . 0.0 108.997 -169.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.7 tt -104.53 146.16 29.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.611 1.564 . . . . 0.0 110.159 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.8 mtt -119.11 133.39 55.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.955 1.302 . . . . 0.0 109.595 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -131.14 139.95 49.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.513 1.525 . . . . 0.0 111.001 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 34.8 t-20 -57.35 119.44 6.47 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.127 1.371 . . . . 0.0 111.259 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.22 -17.63 58.83 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.86 -47.21 0.91 Allowed Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.657 1.122 . . . . 0.0 113.395 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.8 m -76.63 -23.63 53.36 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.978 0.911 . . . . 0.0 112.916 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 71.08 37.0 64.13 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.41 1.005 . . . . 0.0 113.858 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -137.83 136.5 20.0 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 125.203 1.401 . . . . 0.0 111.364 -169.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -53.49 149.51 30.47 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.156 3.238 . . . . 0.0 115.184 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.65 -10.72 0.81 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 176.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -167.68 157.14 10.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.459 1.904 . . . . 0.0 109.336 178.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 19.5 m -145.81 150.19 35.73 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.759 1.224 . . . . 0.0 109.114 169.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.33 138.09 54.63 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 127.369 2.268 . . . . 0.0 108.569 -178.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.0 t -134.72 136.58 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.032 0.933 . . . . 0.0 111.322 -169.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.53 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 36.9 t -120.73 149.6 42.27 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.023 1.729 . . . . 0.0 111.337 177.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.3 p -130.06 0.77 4.73 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.432 1.493 . . . . 0.0 114.276 -177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 136.52 -11.43 4.04 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.456 1.027 . . . . 0.0 115.46 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 89.3 p -156.62 160.29 39.26 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 119.039 1.42 . . . . 0.0 114.022 -172.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 48.7 t-105 -57.39 137.72 81.34 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.832 1.653 . . . . 0.0 114.759 177.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -98.51 176.36 7.94 Favored 'Cis proline' 0 CA--C 1.549 1.232 0 CA-C-N 120.155 1.091 . . . . 0.0 111.376 -10.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.9 mp -71.35 165.13 24.38 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.168 -0.957 . . . . 0.0 110.823 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -120.33 135.48 55.0 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.15 1.38 . . . . 0.0 111.663 -176.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -88.49 149.91 23.4 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.173 1.389 . . . . 0.0 112.054 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.1 t -153.59 170.42 20.86 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.386 1.874 . . . . 0.0 110.66 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.8 mp -101.43 136.77 40.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.111 0.964 . . . . 0.0 108.83 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 35.94 54.82 0.96 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.339 1.856 . . . . 0.0 114.81 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 51.2 ptt85 43.52 33.82 0.7 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.106 2.563 . . . . 0.0 117.015 -177.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.28 -31.5 67.53 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 59.7 p -79.7 -5.18 54.67 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 172.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -137.4 75.76 44.79 Favored Pre-proline 0 N--CA 1.476 0.833 0 C-N-CA 125.614 1.566 . . . . 0.0 112.311 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo . . . . . 0 C--O 1.25 1.115 0 C-N-CA 124.661 3.574 . . . . 0.0 114.293 169.628 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttm . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 110.528 -0.175 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.31 167.05 23.37 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.183 1.393 . . . . 0.0 111.51 178.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -131.59 5.92 4.37 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -169.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.8 50.8 3.35 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 126.236 1.874 . . . . 0.0 114.819 -172.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -132.2 56.46 1.83 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.003 1.721 . . . . 0.0 110.918 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.66 -33.5 4.3 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.285 1.434 . . . . 0.0 114.113 170.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.37 -48.93 65.29 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.934 1.694 . . . . 0.0 113.804 171.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.4 t -73.72 -45.84 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-O 118.6 -0.714 . . . . 0.0 109.948 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.21 -44.38 83.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.607 1.094 . . . . 0.0 112.673 -178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -62.49 -44.25 96.83 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.082 -1.011 . . . . 0.0 111.93 174.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.53 -50.5 72.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.012 0.525 . . . . 0.0 111.111 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -62.54 -37.44 86.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.193 0.997 . . . . 0.0 112.61 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.01 -46.47 89.37 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.128 0.876 . . . . 0.0 111.333 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.74 -37.41 82.12 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.487 1.115 . . . . 0.0 111.885 -178.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -66.08 -46.9 76.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.427 0.691 . . . . 0.0 112.442 171.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 62.7 m -63.07 -35.72 81.18 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.364 1.065 . . . . 0.0 111.281 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.53 79.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.128 1.371 . . . . 0.0 113.685 172.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.83 99.3 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.349 -0.844 . . . . 0.0 111.44 172.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -63.24 -42.55 99.23 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.583 0.753 . . . . 0.0 112.326 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -60.84 -42.31 97.52 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.888 0.767 . . . . 0.0 112.397 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.0 m -60.61 -44.2 96.56 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.419 0.688 . . . . 0.0 110.723 176.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.93 -1.106 . . . . 0.0 113.418 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.61 78.8 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.179 -0.951 . . . . 0.0 112.927 175.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.6 tp -71.3 -34.68 70.83 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.701 1.2 . . . . 0.0 112.038 172.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.1 -44.36 95.92 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.911 -1.118 . . . . 0.0 111.581 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.5 -44.7 62.59 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.438 1.495 . . . . 0.0 111.592 169.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.68 -42.99 97.97 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.284 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.46 -44.45 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 119.146 0.884 . . . . 0.0 110.758 175.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.21 -14.94 29.25 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.979 1.312 . . . . 0.0 113.795 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -112.09 -25.66 9.23 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 176.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.2 -29.6 69.92 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.062 1.301 . . . . 0.0 112.748 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -68.52 -19.15 64.5 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 173.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 pp -117.45 -24.67 7.26 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -169.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.8 m -86.22 -12.92 48.39 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.81 1.82 89.83 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.185 0.834 . . . . 0.0 115.185 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -146.8 148.76 34.15 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 127.733 2.413 . . . . 0.0 107.424 171.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -44.96 147.58 1.91 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.078 2.519 . . . . 0.0 112.868 168.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.8 t -104.48 165.23 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 126.144 1.778 . . . . 0.0 108.411 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.28 176.25 30.62 Favored Glycine 0 CA--C 1.522 0.483 0 O-C-N 120.629 -1.295 . . . . 0.0 115.479 -177.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.4 mt -133.81 121.04 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 125.145 1.378 . . . . 0.0 108.256 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -86.29 148.39 25.64 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.791 1.236 . . . . 0.0 110.482 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -134.84 149.0 50.28 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.88 1.672 . . . . 0.0 112.682 -176.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.6 t -146.0 -179.02 6.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.619 2.368 . . . . 0.0 110.105 177.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -58.22 -30.42 66.47 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 -169.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.8 m -138.48 4.54 2.4 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.823 1.249 . . . . 0.0 113.801 -179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.22 168.72 24.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.072 -1.017 . . . . 0.0 112.959 -173.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 17.8 p90 -157.06 161.85 39.48 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.737 2.015 . . . . 0.0 109.397 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 47.1 ttm-85 -155.04 145.95 22.54 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.103 1.361 . . . . 0.0 110.755 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.1 mm -64.17 146.24 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.48 1.112 . . . . 0.0 110.746 171.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 93.9 mtp -135.19 150.85 50.2 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.884 1.674 . . . . 0.0 110.701 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.7 m -142.16 161.81 48.76 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 125.82 1.648 . . . . 0.0 111.387 -170.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.03 -13.11 25.77 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.023 3.148 . . . . 0.0 116.926 -178.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 35.41 -96.83 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 C-N-CA 127.28 2.371 . . . . 0.0 116.287 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 mmmt -68.15 -29.01 67.81 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -168.57 123.4 0.76 Allowed Pre-proline 0 N--CA 1.477 0.88 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -77.15 -20.76 12.57 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.529 2.819 . . . . 0.0 112.25 169.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 t -76.25 -28.79 57.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.749 1.219 . . . . 0.0 112.796 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -130.99 17.23 5.1 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.9 t-105 60.82 76.51 0.37 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.726 2.01 . . . . 0.0 113.425 169.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.94 59.67 1.67 Allowed 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.928 -1.107 . . . . 0.0 112.667 -177.163 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -44.49 149.4 0.39 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.503 1.921 . . . . 0.0 115.509 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.0 m -142.02 157.15 64.59 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 126.125 1.77 . . . . 0.0 111.163 170.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.56 129.05 21.45 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.815 2.343 . . . . 0.0 109.967 169.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 57.4 tp -74.63 113.11 11.51 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.82 -0.55 . . . . 0.0 109.896 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -138.22 2.5 2.31 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.079 0.952 . . . . 0.0 112.628 169.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.75 -31.2 25.68 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.605 1.962 . . . . 0.0 115.616 -169.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -136.02 26.54 3.27 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.128 1.371 . . . . 0.0 112.029 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -130.27 -12.9 3.99 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.359 1.464 . . . . 0.0 113.222 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.03 -52.92 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 129.717 3.207 . . . . 0.0 114.846 -170.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -152.11 -14.21 0.18 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.723 2.409 . . . . 0.0 113.636 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.94 -1.25 3.8 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.276 -1.515 . . . . 0.0 114.19 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 97.2 p -67.93 -16.33 64.02 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.732 1.613 . . . . 0.0 114.133 170.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -84.49 -173.31 4.65 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -68.75 -119.4 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 125.493 1.517 . . . . 0.0 114.345 175.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.8 t70 60.6 16.78 6.83 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 125.758 1.623 . . . . 0.0 112.623 -167.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 30.8 m0 -77.1 -15.1 59.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.774 1.63 . . . . 0.0 113.348 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -141.32 166.64 24.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.538 1.535 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.68 -33.21 0.26 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.688 2.395 . . . . 0.0 112.116 -176.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -87.92 1.4 54.16 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.028 1.331 . . . . 0.0 113.336 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.9 mt -120.55 166.47 13.58 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 122.979 1.371 . . . . 0.0 114.635 -170.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.5 t -145.13 139.98 27.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 129.244 3.018 . . . . 0.0 106.892 169.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -117.43 146.6 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.163 0.985 . . . . 0.0 111.262 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -139.07 157.34 46.15 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.186 1.794 . . . . 0.0 109.88 175.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.24 170.54 18.73 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 172.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -160.31 161.8 24.86 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 127.819 2.447 . . . . 0.0 109.972 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.86 -15.89 5.48 Favored 'Cis proline' 0 CA--C 1.54 0.775 0 CA-C-N 121.442 1.551 . . . . 0.0 115.65 -10.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -65.43 -176.06 0.3 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.054 1.342 . . . . 0.0 112.692 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.09 147.2 57.73 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.151 0.98 . . . . 0.0 113.071 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -76.13 90.74 1.15 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.941 3.094 . . . . 0.0 110.891 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -155.42 162.31 40.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.222 1.409 . . . . 0.0 111.478 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -74.19 54.42 0.55 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.816 2.047 . . . . 0.0 114.076 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.2 m -58.65 157.01 9.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.308 1.443 . . . . 0.0 113.509 177.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -75.17 2.16 11.55 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -149.61 163.35 25.25 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 127.201 2.2 . . . . 0.0 109.652 179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -65.66 143.13 73.44 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 121.268 1.312 . . . . 0.0 109.564 168.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -73.97 -47.39 37.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.704 -0.622 . . . . 0.0 111.287 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.9 t -83.29 135.17 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.254 1.022 . . . . 0.0 109.314 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 93.8 t -134.98 144.73 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 123.777 0.831 . . . . 0.0 111.15 -178.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.01 118.89 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.034 2.534 . . . . 0.0 109.411 -169.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.6 mt -78.61 161.51 26.92 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.081 0.943 . . . . 0.0 111.692 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.48 -27.39 66.08 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.005 1.322 . . . . 0.0 113.976 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -85.85 -8.14 58.27 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.091 1.756 . . . . 0.0 113.528 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.31 7.45 60.68 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.261 0.934 . . . . 0.0 114.669 -176.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -74.19 138.54 43.83 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.546 1.173 . . . . 0.0 108.502 169.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.1 mm -129.2 150.54 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.008 1.323 . . . . 0.0 109.235 -171.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.0 p -49.22 120.71 10.26 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 124.336 1.054 . . . . 0.0 111.778 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.16 84.44 1.51 Allowed 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.445 2.763 . . . . 0.0 111.71 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -122.01 -179.52 4.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.218 1.807 . . . . 0.0 111.878 -178.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 m -142.29 144.51 33.3 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.142 -0.974 . . . . 0.0 112.165 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.87 144.84 48.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 128.815 2.846 . . . . 0.0 108.78 -175.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -135.6 146.75 48.25 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.373 1.469 . . . . 0.0 110.688 -178.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 56.3 mtt -123.55 131.58 53.67 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 110.005 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.79 145.3 50.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.23 1.812 . . . . 0.0 110.932 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -52.99 129.75 31.57 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.531 1.132 . . . . 0.0 110.302 172.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.4 -18.32 17.17 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.377 1.992 . . . . 0.0 116.377 -174.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.4 -37.89 0.47 Allowed Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.749 -1.028 . . . . 0.0 115.222 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 48.5 p -77.72 -26.05 49.77 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.793 1.796 . . . . 0.0 112.523 171.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.24 5.19 75.98 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.78 1.181 . . . . 0.0 114.104 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.66 124.34 90.65 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.002 1.321 . . . . 0.0 111.451 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.31 142.96 78.17 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.328 2.685 . . . . 0.0 113.292 170.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.69 -35.05 4.04 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.088 0.955 . . . . 0.0 111.555 172.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.8 tp -151.47 153.78 35.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.539 1.136 . . . . 0.0 111.055 -169.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.9 m -142.79 144.72 32.7 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 125.739 1.615 . . . . 0.0 108.814 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.3 mp -124.01 137.57 54.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.599 1.96 . . . . 0.0 108.759 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.2 t -134.49 138.39 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.124 0.97 . . . . 0.0 111.113 -169.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.8 t -116.18 117.61 30.53 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.494 1.118 . . . . 0.0 111.552 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -76.31 -8.13 56.45 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 122.19 0.94 10.46 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.481 1.515 . . . . 0.0 114.376 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 82.5 p -156.92 159.39 38.06 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.174 -1.192 . . . . 0.0 113.412 -173.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -62.51 138.43 96.54 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.997 1.719 . . . . 0.0 115.074 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -94.84 174.55 13.49 Favored 'Cis proline' 0 CA--C 1.546 1.097 0 CA-C-N 119.947 1.017 . . . . 0.0 110.812 -11.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.96 153.75 43.06 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 122.269 1.033 . . . . 0.0 110.889 169.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -100.99 116.1 32.04 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.694 1.598 . . . . 0.0 110.752 -177.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -77.22 145.42 37.6 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.401 1.081 . . . . 0.0 111.291 176.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.8 t -147.47 148.3 31.1 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.957 1.703 . . . . 0.0 110.588 169.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -72.19 132.59 44.33 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.46 -0.775 . . . . 0.0 109.434 170.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.01 66.02 0.06 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.294 2.237 . . . . 0.0 115.836 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 32.7 mtm105 56.34 21.89 5.84 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.31 -27.39 67.28 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.978 1.717 . . . . 0.0 114.791 -177.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 69.4 p -101.52 7.2 42.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.817 1.247 . . . . 0.0 113.792 169.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 19.1 tpt85 -136.59 45.19 1.16 Allowed Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 126.362 1.865 . . . . 0.0 112.971 -173.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo . . . . . 0 C--O 1.251 1.155 0 C-N-CA 124.031 3.154 . . . . 0.0 114.068 -173.505 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 N--CA 1.471 0.607 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.51 -39.95 81.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.052 1.296 . . . . 0.0 114.493 -169.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 t -65.6 -49.2 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.869 0.868 . . . . 0.0 110.492 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.13 -38.73 88.88 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.572 0.749 . . . . 0.0 112.418 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -62.25 -41.77 98.73 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.095 0.958 . . . . 0.0 111.224 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.5 m -63.48 -48.24 78.48 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.799 -0.563 . . . . 0.0 111.619 173.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.5 mmt-85 -61.69 -32.15 72.33 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.403 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.92 76.75 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.675 1.58 . . . . 0.0 111.848 173.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.0 mtm105 -62.2 -41.15 98.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.641 0.776 . . . . 0.0 111.73 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.11 -49.4 77.45 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -35.66 76.31 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.215 1.006 . . . . 0.0 111.484 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.18 88.11 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.57 97.82 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.084 0.856 . . . . 0.0 111.86 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.0 mtt85 -62.19 -45.57 92.78 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.63 1.172 . . . . 0.0 111.707 176.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -60.78 -44.28 97.0 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.623 0.769 . . . . 0.0 112.653 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.8 m -60.55 -43.42 97.24 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.912 0.778 . . . . 0.0 110.78 178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.83 97.07 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.975 -1.078 . . . . 0.0 113.276 172.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -32.18 73.66 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.275 -0.89 . . . . 0.0 113.115 175.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.3 tp -73.56 -33.72 64.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.204 1.401 . . . . 0.0 111.786 172.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.82 -45.33 93.13 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.892 -1.13 . . . . 0.0 110.704 169.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 tp -52.2 -46.39 65.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.439 1.496 . . . . 0.0 111.324 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.64 96.92 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.81 -45.42 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.708 0.803 . . . . 0.0 110.689 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.06 -35.74 79.56 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.675 0.79 . . . . 0.0 112.815 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.338 1.055 . . . . 0.0 113.164 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.14 -37.88 88.97 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -177.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -70.01 -28.55 65.59 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 121.527 -0.733 . . . . 0.0 112.504 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.3 mt -80.72 -31.99 35.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.081 1.352 . . . . 0.0 112.971 178.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.4 m -82.21 -20.23 38.17 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -170.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.75 3.4 79.46 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -143.03 149.12 47.99 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.127 2.571 . . . . 0.0 107.175 172.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -45.54 143.51 5.89 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.647 2.231 . . . . 0.0 111.807 168.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 25.6 t -88.14 162.5 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.587 1.155 . . . . 0.0 108.716 173.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.93 176.63 23.13 Favored Glycine 0 N--CA 1.46 0.282 0 O-C-N 121.261 -0.9 . . . . 0.0 113.567 173.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.5 mt -137.3 117.18 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.672 1.189 . . . . 0.0 108.813 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -74.77 146.87 41.77 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.239 1.816 . . . . 0.0 110.473 170.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -145.17 133.99 22.36 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.403 1.481 . . . . 0.0 110.351 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -150.74 27.17 0.72 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.057 1.343 . . . . 0.0 113.442 -173.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.8 t0 63.08 -66.97 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 128.242 2.617 . . . . 0.0 113.867 -176.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 75.2 m -66.54 -24.34 66.36 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.909 0.884 . . . . 0.0 113.162 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.05 169.79 21.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.559 1.144 . . . . 0.0 112.048 174.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.5 p90 -153.98 164.41 38.47 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.596 2.758 . . . . 0.0 107.469 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -167.09 146.8 5.37 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.615 1.098 . . . . 0.0 112.713 172.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mm -66.29 152.89 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.473 0.709 . . . . 0.0 109.175 170.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.1 mtp -142.94 151.29 40.79 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.635 1.574 . . . . 0.0 111.96 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.66 164.0 37.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.432 1.893 . . . . 0.0 111.521 -169.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -63.15 167.7 12.1 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.753 2.302 . . . . 0.0 113.47 171.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -156.98 163.27 32.21 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.888 1.709 . . . . 0.0 110.67 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm 59.05 -44.46 0.07 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 128.303 2.641 . . . . 0.0 115.885 -169.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.8 t -155.08 141.63 13.26 Favored Pre-proline 0 N--CA 1.472 0.656 0 C-N-CA 125.794 1.637 . . . . 0.0 111.797 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -79.8 -16.93 11.26 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 C-N-CA 123.188 2.592 . . . . 0.0 112.442 169.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.8 m -77.66 -7.03 55.83 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -169.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.38 151.62 36.81 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.014 1.325 . . . . 0.0 111.48 178.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.3 t-105 -52.69 112.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.946 1.699 . . . . 0.0 112.452 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -152.78 157.42 40.77 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.518 1.527 . . . . 0.0 110.221 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -143.15 143.7 31.91 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -174.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -145.41 139.71 15.21 Favored Pre-proline 0 N--CA 1.472 0.639 0 C-N-CA 128.73 2.812 . . . . 0.0 107.717 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.45 130.83 24.67 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.521 2.147 . . . . 0.0 111.635 174.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -79.3 78.08 5.8 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.796 0.839 . . . . 0.0 110.914 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -136.08 25.98 3.27 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.375 1.47 . . . . 0.0 112.133 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -58.71 -25.04 62.49 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 171.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -149.95 -26.8 0.25 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.108 1.363 . . . . 0.0 113.779 169.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.95 24.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 125.411 1.484 . . . . 0.0 114.193 169.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.36 121.15 8.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.562 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 55.13 22.84 4.84 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -173.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -119.32 -30.71 4.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.484 1.514 . . . . 0.0 110.686 169.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.9 t -67.9 -21.14 65.16 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.979 1.712 . . . . 0.0 112.308 169.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -137.4 152.79 50.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.217 1.407 . . . . 0.0 114.54 -169.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 46.95 -34.58 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.179 1 C-N-CA 131.974 4.11 . . . . 0.0 120.882 169.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.76 -15.62 63.02 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -169.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -68.43 -15.07 63.42 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -146.53 171.09 15.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.374 1.07 . . . . 0.0 113.696 -176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -142.9 17.87 1.96 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.746 1.618 . . . . 0.0 112.582 172.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -144.53 0.59 1.01 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -168.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.8 mt -121.88 161.27 23.1 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -168.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.3 m -130.61 136.26 48.68 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.991 2.916 . . . . 0.0 106.685 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.93 141.53 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 125.01 1.324 . . . . 0.0 110.516 -169.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -139.08 153.42 48.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.52 1.528 . . . . 0.0 109.29 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.57 171.07 16.72 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 172.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.33 154.97 28.3 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 127.634 2.374 . . . . 0.0 109.707 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.94 -10.93 27.07 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 CA-C-N 121.368 1.524 . . . . 0.0 114.633 0.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -67.84 -171.43 0.21 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.27 1.428 . . . . 0.0 110.988 169.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.3 147.44 43.56 Favored Pre-proline 0 N--CA 1.479 0.976 0 O-C-N 120.787 -1.195 . . . . 0.0 112.82 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.1 105.23 1.15 Allowed 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.12 2.546 . . . . 0.0 109.543 174.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -160.98 137.87 8.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.885 1.274 . . . . 0.0 111.306 -169.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -69.78 46.6 0.07 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.355 2.662 . . . . 0.0 114.313 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.3 t -63.25 158.97 18.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.37 1.868 . . . . 0.0 114.159 -176.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -71.25 -5.09 29.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.974 1.31 . . . . 0.0 113.41 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -131.11 164.2 43.89 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 125.794 1.638 . . . . 0.0 111.321 176.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.02 162.12 36.78 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.45 2.1 . . . . 0.0 112.472 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -99.12 -12.22 20.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.12 1.368 . . . . 0.0 112.78 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.3 t -132.26 148.81 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 126.206 1.802 . . . . 0.0 109.398 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 73.0 t -135.49 143.09 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.77 1.228 . . . . 0.0 111.392 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -129.45 126.58 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 128.795 2.838 . . . . 0.0 109.91 -169.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.0 mt -83.98 159.81 21.16 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.123 0.963 . . . . 0.0 112.092 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.87 -26.58 67.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.2 1.4 . . . . 0.0 113.939 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -82.3 -8.6 59.64 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.651 1.58 . . . . 0.0 113.335 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.63 5.72 62.92 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.506 1.051 . . . . 0.0 114.735 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -72.01 138.83 48.23 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.507 1.154 . . . . 0.0 108.962 169.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 6.9 mm -128.05 132.9 68.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 124.558 1.143 . . . . 0.0 109.422 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.3 m -61.02 118.63 37.62 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.261 1.424 . . . . 0.0 110.431 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -52.07 132.7 44.16 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 124.017 3.144 . . . . 0.0 115.294 -176.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.432 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 8.7 p90 -162.72 174.66 12.22 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.525 1.93 . . . . 0.0 111.667 175.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.6 m -137.01 139.95 41.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.622 1.169 . . . . 0.0 109.463 169.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.2 tp -131.66 122.42 25.95 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.857 2.063 . . . . 0.0 109.01 -169.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.4 tt -118.78 144.58 46.2 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.265 1.826 . . . . 0.0 110.995 -169.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.1 mtt -123.54 128.3 49.55 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.093 1.357 . . . . 0.0 110.868 -176.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.16 139.13 54.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.071 1.349 . . . . 0.0 111.458 -178.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.516 ' HB2' HD11 ' A' ' 121' ' ' LEU . 42.5 t-20 -64.18 113.57 3.64 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.795 1.638 . . . . 0.0 110.893 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.59 -18.02 50.2 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -87.17 -17.23 59.49 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.721 1.153 . . . . 0.0 114.825 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.8 p -135.97 -28.74 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.171 1.485 . . . . 0.0 114.159 -169.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 89.64 -3.34 83.34 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.818 1.675 . . . . 0.0 113.885 -173.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -79.17 137.22 56.69 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 118.831 1.316 . . . . 0.0 112.496 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.96 142.4 42.55 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.898 2.399 . . . . 0.0 111.685 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 114' ' ' ASN . 0.2 OUTLIER -113.88 -35.18 5.2 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.717 0.807 . . . . 0.0 112.266 177.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.429 HD21 HE21 ' A' ' 134' ' ' GLN . 6.3 tp -155.74 151.55 27.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.257 1.023 . . . . 0.0 111.178 -168.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 75.6 m -139.83 152.83 46.83 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.506 1.122 . . . . 0.0 109.172 169.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.6 mt -124.66 142.53 51.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.681 2.392 . . . . 0.0 108.351 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 34.1 t -135.2 136.24 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.73 0.812 . . . . 0.0 111.969 -169.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.432 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.1 t -124.67 135.13 52.79 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.266 1.826 . . . . 0.0 110.919 -179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.1 m -131.09 7.65 4.67 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.384 1.074 . . . . 0.0 113.824 -176.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 144.73 -18.31 2.01 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.389 1.316 . . . . 0.0 116.389 172.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.3 t -157.36 155.79 31.2 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.786 1.793 . . . . 0.0 113.623 -172.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -58.59 141.8 83.75 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 115.589 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -93.18 178.34 11.88 Favored 'Cis proline' 0 CA--C 1.547 1.173 0 CA-C-N 119.757 0.949 . . . . 0.0 110.769 -11.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.89 155.77 38.65 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.107 -0.996 . . . . 0.0 111.801 169.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.07 119.81 37.36 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.231 1.412 . . . . 0.0 110.867 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.429 HE21 HD21 ' A' ' 122' ' ' LEU . 53.2 tt0 -81.98 143.26 31.73 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.57 1.548 . . . . 0.0 111.323 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 3.4 t -142.75 145.01 32.87 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.013 1.325 . . . . 0.0 111.306 175.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.58 137.06 49.73 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 169.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 40.36 -97.98 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.125 1.77 . . . . 0.0 113.314 -169.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -135.35 22.18 3.43 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.524 1.53 . . . . 0.0 112.235 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.01 -21.44 21.4 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -169.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 1.2 t -120.8 11.97 11.24 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 73.91 71.34 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 125.117 1.367 . . . . 0.0 111.628 -170.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 C--O 1.251 1.132 0 C-N-CA 124.738 3.625 . . . . 0.0 114.685 175.358 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.627 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.34 -38.75 84.78 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.316 0.962 . . . . 0.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -63.86 -46.21 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.875 0.87 . . . . 0.0 110.679 173.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -41.75 97.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.36 0.527 . . . . 0.0 112.231 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -63.3 -44.98 93.45 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.398 0.999 . . . . 0.0 111.913 173.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -58.42 -53.04 62.81 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.308 0.643 . . . . 0.0 110.807 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.4 mmp_? -62.0 -32.96 73.48 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.299 1.039 . . . . 0.0 113.049 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.69 -50.98 69.0 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.186 1.357 . . . . 0.0 111.42 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -67.06 -36.06 81.2 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.803 -0.561 . . . . 0.0 111.455 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -63.48 -44.69 93.69 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 169.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.4 m -58.22 -41.17 83.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.361 -0.837 . . . . 0.0 111.075 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.91 -40.48 91.51 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.26 97.63 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.349 0.977 . . . . 0.0 111.954 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -62.63 -44.09 97.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.932 1.293 . . . . 0.0 111.405 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -59.27 -44.82 92.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.489 0.715 . . . . 0.0 112.417 170.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -61.34 -43.12 99.41 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.079 0.854 . . . . 0.0 111.037 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.04 99.57 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 120.784 -1.197 . . . . 0.0 113.082 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.82 -32.4 73.66 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 121.317 -0.864 . . . . 0.0 113.116 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 35.3 tp -71.13 -31.98 68.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.667 1.587 . . . . 0.0 111.783 172.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.3 -44.93 93.62 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.985 -1.072 . . . . 0.0 111.135 169.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -52.88 -46.13 67.79 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.097 1.359 . . . . 0.0 111.417 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.33 96.86 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.72 -45.61 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.241 1.016 . . . . 0.0 111.016 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -60.18 -34.48 73.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.76 0.824 . . . . 0.0 112.665 177.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -80.82 -36.07 32.09 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.98 -31.18 68.53 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.63 -11.25 60.36 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 74.5 mt -114.19 -31.6 6.27 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.363 1.865 . . . . 0.0 113.42 -173.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.8 p -72.88 -20.87 61.02 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.045 1.738 . . . . 0.0 115.563 -172.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.23 -20.32 30.51 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.637 1.113 . . . . 0.0 114.313 176.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -128.38 147.02 62.08 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 127.861 2.465 . . . . 0.0 106.925 169.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -42.26 154.04 0.12 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.86 3.04 . . . . 0.0 114.511 169.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.6 162.24 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 126.119 1.768 . . . . 0.0 108.657 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.49 178.37 33.86 Favored Glycine 0 N--CA 1.468 0.828 0 CA-C-N 120.752 1.615 . . . . 0.0 115.35 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.6 124.11 53.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.737 1.215 . . . . 0.0 110.178 177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -79.39 139.87 37.61 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 126.599 1.96 . . . . 0.0 109.433 169.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -138.39 134.53 34.26 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 125.406 1.482 . . . . 0.0 108.872 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.1 t -142.76 -175.67 4.58 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.946 1.298 . . . . 0.0 111.843 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -55.69 -26.96 47.64 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -169.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.84 -5.37 1.33 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.52 175.66 13.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.621 1.168 . . . . 0.0 112.317 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 32.4 p90 -151.8 157.95 42.63 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.451 1.901 . . . . 0.0 110.138 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.5 ttp180 -159.26 134.15 8.1 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.804 1.242 . . . . 0.0 112.39 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.2 mt -68.21 147.01 12.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 123.811 0.844 . . . . 0.0 110.114 176.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 84.4 mtp -135.99 154.46 51.07 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.942 1.697 . . . . 0.0 111.249 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 m -146.85 165.23 20.02 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 126.16 1.784 . . . . 0.0 111.256 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -62.93 159.14 39.53 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.168 1.912 . . . . 0.0 111.184 169.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -152.87 -62.16 0.01 OUTLIER Glycine 0 N--CA 1.475 1.235 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -65.63 -29.43 70.01 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.313 1.056 . . . . 0.0 113.625 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 t -154.1 137.64 10.54 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 125.102 1.361 . . . . 0.0 110.375 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -80.75 2.62 8.41 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.127 3.218 . . . . 0.0 113.193 170.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.0 m -122.43 -2.25 9.0 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -148.01 153.52 39.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.205 1.002 . . . . 0.0 111.914 173.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.8 t-105 -53.14 105.56 0.13 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.858 1.663 . . . . 0.0 114.331 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.515 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.8 tpm_? -156.05 159.01 38.75 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.999 1.72 . . . . 0.0 110.207 169.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.515 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 96.6 m95 -140.04 139.32 35.93 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.265 1.426 . . . . 0.0 112.093 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.51 154.87 73.79 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 126.907 2.083 . . . . 0.0 109.411 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.47 136.27 36.15 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.531 2.154 . . . . 0.0 112.616 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.72 -16.95 64.25 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.842 1.257 . . . . 0.0 112.869 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -48.36 -18.94 0.26 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.319 1.848 . . . . 0.0 113.438 168.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -50.75 -28.62 9.57 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.796 1.239 . . . . 0.0 113.883 169.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -139.71 0.26 1.8 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 117.119 2.266 . . . . 0.0 117.119 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.39 57.57 1.8 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.706 1.203 . . . . 0.0 109.515 169.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.68 -27.27 0.47 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 118.266 2.691 . . . . 0.0 118.266 -169.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -129.73 2.89 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 114.576 1.324 . . . . 0.0 114.576 -174.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -127.11 -13.06 5.73 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.533 1.133 . . . . 0.0 113.634 -178.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 52.1 p -73.66 -10.72 59.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.93 1.292 . . . . 0.0 114.411 172.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -121.18 177.25 5.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.031 1.732 . . . . 0.0 111.482 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -54.17 126.29 22.35 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.04 0.924 . . . . 0.0 112.954 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -157.49 29.94 0.28 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 128.993 2.917 . . . . 0.0 107.41 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -112.83 -9.32 13.67 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -167.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.39 170.21 16.42 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.391 1.076 . . . . 0.0 113.552 -175.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -138.92 2.46 2.15 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.71 1.204 . . . . 0.0 114.246 173.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -156.47 17.02 0.33 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.131 0.972 . . . . 0.0 113.444 -169.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.52 157.16 32.64 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.345 -1.472 . . . . 0.0 113.086 -169.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.8 t -135.82 142.85 44.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.854 2.062 . . . . 0.0 109.063 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.99 147.18 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.597 1.159 . . . . 0.0 111.14 -169.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -137.22 162.47 33.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.092 1.757 . . . . 0.0 110.264 173.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 73.6 mt -127.91 158.73 37.02 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.14 139.93 13.56 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 125.684 1.594 . . . . 0.0 109.227 169.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -76.4 -7.59 27.93 Favored 'Cis proline' 0 CA--C 1.545 1.043 0 CA-C-N 121.537 1.585 . . . . 0.0 113.399 -8.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -62.96 177.94 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.262 1.425 . . . . 0.0 112.167 169.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -135.78 146.68 58.1 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.6 1.16 . . . . 0.0 113.352 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -81.57 107.05 1.75 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.439 2.759 . . . . 0.0 110.115 169.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -157.77 160.01 37.39 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.087 0.955 . . . . 0.0 112.342 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.99 38.43 0.11 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 127.468 2.307 . . . . 0.0 114.02 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.8 m -59.4 156.62 12.56 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.008 1.723 . . . . 0.0 114.353 -175.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -69.6 -0.98 7.63 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.402 1.481 . . . . 0.0 114.629 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -143.58 165.19 26.28 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 127.448 2.299 . . . . 0.0 110.278 -176.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.72 155.82 64.95 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.172 1.915 . . . . 0.0 111.965 169.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -91.24 -14.95 30.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.663 1.185 . . . . 0.0 112.493 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.3 t -132.46 139.22 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 126.103 1.761 . . . . 0.0 109.078 177.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 83.1 t -133.09 147.53 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 119.443 1.02 . . . . 0.0 112.227 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -126.86 116.43 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 128.66 2.784 . . . . 0.0 108.942 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -70.83 160.32 32.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.209 1.804 . . . . 0.0 111.981 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.97 -7.05 10.03 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -121.67 10.67 10.38 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 0.0 112.992 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.95 7.86 63.91 Favored Glycine 0 CA--C 1.535 1.331 0 N-CA-C 115.963 1.145 . . . . 0.0 115.963 173.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -75.65 150.95 37.84 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.947 1.373 . . . . 0.0 107.801 169.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.5 mm -130.41 143.61 40.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 124.531 1.132 . . . . 0.0 108.939 -172.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 p -52.05 118.89 13.01 Favored Pre-proline 0 N--CA 1.473 0.699 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.1 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.78 115.06 2.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.016 2.477 . . . . 0.0 112.811 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.514 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.8 p90 -155.03 179.14 9.43 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.006 1.323 . . . . 0.0 112.908 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.9 p -143.24 152.91 42.25 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 125.331 1.452 . . . . 0.0 110.883 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.45 119.21 17.2 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 127.265 2.226 . . . . 0.0 108.806 -169.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.2 tt -110.94 145.86 37.62 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.349 1.46 . . . . 0.0 110.353 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 42.9 mtt -127.29 129.99 48.71 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.816 1.247 . . . . 0.0 110.355 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -129.99 141.71 50.72 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.528 1.531 . . . . 0.0 112.192 -171.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -61.05 109.92 1.22 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.321 1.849 . . . . 0.0 110.925 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -18.22 57.03 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -177.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.59 -16.47 68.38 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.314 0.959 . . . . 0.0 114.561 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.8 m -130.53 -27.53 2.15 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.706 1.253 . . . . 0.0 113.64 -169.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.83 36.86 40.77 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.1 0.857 . . . . 0.0 113.09 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -131.83 129.05 21.82 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.221 1.409 . . . . 0.0 111.071 -170.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.54 148.54 52.76 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.841 3.027 . . . . 0.0 114.914 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.12 -38.94 2.97 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.109 1.364 . . . . 0.0 110.973 169.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 39.9 tp -148.58 152.51 36.91 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 126.256 1.822 . . . . 0.0 110.151 -168.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.2 m -145.15 148.88 34.07 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 124.452 1.101 . . . . 0.0 108.931 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.6 mp -117.98 146.55 43.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 127.253 2.221 . . . . 0.0 108.405 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.23 141.67 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.122 0.969 . . . . 0.0 111.298 -174.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 21.9 t -120.38 121.25 38.15 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.94 1.696 . . . . 0.0 111.662 -176.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 61.7 p -74.94 -14.52 60.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.76 1.224 . . . . 0.0 114.004 170.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.33 2.77 4.02 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 125.786 1.66 . . . . 0.0 114.449 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.7 t -152.91 161.09 42.98 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.956 1.378 . . . . 0.0 113.136 -175.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -46.98 144.81 3.62 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 127.435 2.294 . . . . 0.0 113.774 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -107.87 17.25 6.93 Favored 'Cis proline' 0 CA--C 1.55 1.312 0 CA-C-N 120.744 1.301 . . . . 0.0 114.381 -2.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp 74.29 168.49 0.3 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 127.696 2.398 . . . . 0.0 112.405 -169.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -129.14 135.78 49.33 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.514 1.126 . . . . 0.0 111.558 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -82.68 155.77 24.18 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.725 1.21 . . . . 0.0 112.82 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 10.9 t -151.23 140.66 21.5 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.607 1.963 . . . . 0.0 109.976 169.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.61 130.63 43.63 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.389 -0.82 . . . . 0.0 109.383 169.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.07 63.2 0.27 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.376 1.871 . . . . 0.0 115.381 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 47.72 24.01 0.5 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 117.737 2.495 . . . . 0.0 117.737 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -57.67 -28.91 64.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -175.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.5 p -91.41 -8.15 48.7 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 175.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -63.95 -39.71 47.85 Favored Pre-proline 0 N--CA 1.478 0.975 0 CA-C-O 115.95 -1.976 . . . . 0.0 115.019 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo . . . . . 0 C--O 1.251 1.127 0 C-N-CA 124.09 3.194 . . . . 0.0 115.296 177.425 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.46 -14.68 5.26 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.734 2.413 . . . . 0.0 114.761 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.2 t -118.13 -41.61 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.334 1.454 . . . . 0.0 110.514 170.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.39 79.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.301 0.955 . . . . 0.0 113.531 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.618 ' HA ' HD11 ' A' ' 121' ' ' LEU . 11.1 m120 -57.06 -34.93 68.75 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.188 0.904 . . . . 0.0 113.284 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.8 m -81.84 -49.85 9.89 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.183 0.993 . . . . 0.0 111.053 174.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -67.28 -26.67 66.66 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' HD12 ' A' ' 121' ' ' LEU . . . -63.9 -43.94 94.46 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.719 1.145 . . . . 0.0 111.812 169.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -67.19 -37.88 84.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.887 0.875 . . . . 0.0 110.922 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -63.06 -46.15 88.82 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.6 m -58.74 -40.91 85.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.934 0.893 . . . . 0.0 111.242 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.34 92.98 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.573 1.149 . . . . 0.0 113.297 174.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.53 96.86 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.801 . . . . 0.0 112.056 173.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.7 mtt85 -62.75 -45.65 91.7 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.561 1.144 . . . . 0.0 111.553 175.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -57.95 -45.33 86.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.727 0.811 . . . . 0.0 112.559 170.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.6 m -62.01 -43.29 99.14 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.886 0.766 . . . . 0.0 111.02 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.16 96.65 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.869 -1.144 . . . . 0.0 112.968 172.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.56 -32.14 73.57 Favored 'General case' 0 CA--C 1.547 0.842 0 O-C-N 121.346 -0.846 . . . . 0.0 113.269 175.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 tp -72.51 -34.68 67.78 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.879 1.272 . . . . 0.0 111.74 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.42 -45.09 94.68 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.969 -1.082 . . . . 0.0 110.778 169.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.89 -46.54 64.57 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.325 1.45 . . . . 0.0 110.921 169.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.16 -39.54 94.97 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.62 -46.33 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.833 0.853 . . . . 0.0 110.784 174.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.08 -38.17 87.8 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.137 0.575 . . . . 0.0 112.525 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -68.18 -34.15 75.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.402 1.081 . . . . 0.0 112.281 175.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -24.67 64.15 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.9 t -83.46 -12.32 56.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.262 0.937 . . . . 0.0 112.884 173.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.88 -27.57 9.64 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.367 1.067 . . . . 0.0 113.559 -174.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.0 m -85.12 -20.74 29.84 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.59 0.59 89.28 Favored Glycine 0 CA--C 1.542 1.724 0 N-CA-C 115.233 0.853 . . . . 0.0 115.233 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -142.35 151.11 57.22 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 127.611 2.364 . . . . 0.0 107.168 169.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -47.05 157.46 0.58 Allowed 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.912 2.408 . . . . 0.0 113.0 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 78.2 t -120.02 158.99 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.173 1.389 . . . . 0.0 108.904 -173.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.39 174.51 30.55 Favored Glycine 0 CA--C 1.519 0.327 0 O-C-N 121.316 -0.865 . . . . 0.0 115.102 -177.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.5 122.2 47.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 C-N-CA 124.774 1.23 . . . . 0.0 107.817 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -90.55 146.12 24.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.345 1.458 . . . . 0.0 110.579 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -140.88 131.71 25.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.977 1.711 . . . . 0.0 110.572 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 82.5 p -148.82 169.56 20.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.792 1.237 . . . . 0.0 112.495 175.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.14 -29.53 68.71 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 171.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 51.8 m -76.46 -49.88 15.48 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.262 1.025 . . . . 0.0 112.626 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.19 173.22 9.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.903 1.681 . . . . 0.0 112.1 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 38.5 p90 -127.62 147.43 50.36 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.328 1.451 . . . . 0.0 109.101 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.8 ptt-85 -155.62 147.54 23.32 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.31 1.044 . . . . 0.0 113.088 -169.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.5 mm -78.71 140.56 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.055 0.942 . . . . 0.0 109.209 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.7 mtp -136.17 148.53 48.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.164 0.986 . . . . 0.0 112.932 -177.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.6 m -143.79 169.67 9.92 Favored Pre-proline 0 N--CA 1.477 0.91 0 C-N-CA 127.709 2.404 . . . . 0.0 111.158 -169.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -54.81 -41.84 74.36 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.99 2.46 . . . . 0.0 114.312 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.87 -65.47 0.02 OUTLIER Glycine 0 CA--C 1.537 1.454 0 C-N-CA 127.624 2.535 . . . . 0.0 115.767 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -68.48 -54.63 15.66 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.28 1.432 . . . . 0.0 112.31 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.4 t -161.23 143.32 9.04 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 124.459 1.104 . . . . 0.0 112.296 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -79.93 -16.78 11.16 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 123.458 2.772 . . . . 0.0 112.789 169.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.8 m -73.92 -13.0 60.83 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -169.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -150.27 153.07 35.53 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.281 1.433 . . . . 0.0 111.031 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -58.24 113.18 1.82 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.859 1.264 . . . . 0.0 111.798 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.504 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.5 tpm_? -154.07 161.36 41.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.346 1.458 . . . . 0.0 110.174 174.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.504 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 92.7 m95 -139.8 139.64 36.45 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.991 1.316 . . . . 0.0 112.199 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.9 t -143.84 141.9 19.49 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 107.149 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -61.84 146.97 96.19 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 121.679 1.586 . . . . 0.0 111.065 170.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.4 tp -66.98 10.91 0.12 Allowed 'General case' 0 CA--C 1.555 1.155 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -61.85 -18.94 61.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.408 1.483 . . . . 0.0 112.729 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -62.05 -20.93 64.48 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.131 1.372 . . . . 0.0 113.987 171.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -146.27 -20.88 0.44 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 -175.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -111.41 11.86 21.5 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.493 1.117 . . . . 0.0 112.724 172.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.29 -169.25 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.181 2.192 . . . . 0.0 114.467 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -59.8 -11.11 4.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -68.37 -8.97 44.84 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.52 1.528 . . . . 0.0 113.763 170.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.0 m -63.64 8.87 0.07 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.609 1.964 . . . . 0.0 115.938 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -156.05 162.24 40.32 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.953 1.301 . . . . 0.0 114.113 -169.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.439 ' ND2' ' H ' ' A' ' 75' ' ' ASP . 7.2 t30 48.48 -158.36 0.06 Allowed 'General case' 0 CA--C 1.561 1.392 0 C-N-CA 126.902 2.081 . . . . 0.0 115.689 169.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.439 ' H ' ' ND2' ' A' ' 74' ' ' ASN . 1.0 OUTLIER 56.75 -6.76 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 120.669 3.581 . . . . 0.0 120.669 168.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -60.39 -21.13 61.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.853 1.661 . . . . 0.0 114.21 173.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -129.32 159.33 36.49 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.336 1.855 . . . . 0.0 112.244 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -141.88 18.53 2.14 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.37 1.068 . . . . 0.0 113.545 169.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.05 4.49 0.47 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.783 1.233 . . . . 0.0 113.993 -172.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -125.71 170.83 11.15 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.279 1.832 . . . . 0.0 111.5 -171.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 21.4 t -136.82 141.52 42.88 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.432 1.893 . . . . 0.0 109.123 169.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.64 145.6 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.348 1.459 . . . . 0.0 111.198 -169.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -141.05 152.31 44.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.197 1.799 . . . . 0.0 110.567 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.6 mt -118.96 144.8 46.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.211 1.004 . . . . 0.0 111.439 171.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -172.81 114.44 0.37 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 127.217 2.207 . . . . 0.0 110.585 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.74 156.4 4.28 Favored 'Cis proline' 0 N--CA 1.452 -0.922 0 CA-C-N 121.363 1.523 . . . . 0.0 115.586 -10.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 79.31 -171.8 0.05 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 130.299 3.44 . . . . 0.0 110.947 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.65 148.41 43.03 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 124.183 0.993 . . . . 0.0 113.078 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.06 84.86 1.91 Allowed 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.787 2.991 . . . . 0.0 111.39 175.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -142.71 142.83 32.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.93 1.292 . . . . 0.0 111.148 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -71.74 66.06 0.52 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.537 1.535 . . . . 0.0 114.155 -173.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.5 t -67.15 156.64 35.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.603 1.961 . . . . 0.0 113.661 -178.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -69.25 -8.4 45.58 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.32 1.448 . . . . 0.0 113.451 171.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -136.49 163.61 48.61 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 126.204 1.801 . . . . 0.0 111.368 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -69.88 145.47 56.52 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 121.814 1.676 . . . . 0.0 110.477 168.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.01 -49.4 24.49 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.043 0.537 . . . . 0.0 110.957 171.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.4 t -89.8 135.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.962 1.305 . . . . 0.0 109.663 -177.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.2 t -132.89 145.6 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.906 0.882 . . . . 0.0 111.644 -176.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -127.81 136.33 60.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 128.445 2.698 . . . . 0.0 109.279 -169.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.6 mt -104.97 161.37 14.26 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.772 0.796 . . . . 0.0 112.074 170.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.44 -22.17 41.7 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -170.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -103.59 5.13 36.38 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.952 1.301 . . . . 0.0 113.781 -177.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.51 8.74 57.19 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 115.552 0.981 . . . . 0.0 115.552 172.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -84.45 139.43 32.2 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.211 1.505 . . . . 0.0 108.161 169.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.9 mm -130.9 154.65 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 125.461 1.504 . . . . 0.0 109.858 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.1 p -55.73 127.93 68.46 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.857 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.74 126.85 11.08 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 122.203 1.935 . . . . 0.0 111.047 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.531 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.5 p90 -160.38 -177.41 6.21 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.905 1.682 . . . . 0.0 112.069 -177.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.58 148.68 39.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.698 0.799 . . . . 0.0 111.165 170.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.0 tp -133.17 120.35 21.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 127.929 2.492 . . . . 0.0 108.257 -170.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.5 tt -115.32 146.14 41.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.525 1.13 . . . . 0.0 110.413 -174.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 48.4 mtt -128.3 140.43 51.88 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 125.404 1.481 . . . . 0.0 109.561 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.09 147.59 49.58 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.742 1.217 . . . . 0.0 111.481 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -61.41 122.39 15.06 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.312 1.045 . . . . 0.0 109.838 173.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.18 -21.31 64.99 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -171.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -96.64 -28.57 8.83 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-N 119.119 0.872 . . . . 0.0 114.219 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 79.6 p -93.01 -27.94 16.7 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.682 1.241 . . . . 0.0 112.969 176.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.96 7.93 72.01 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.695 1.14 . . . . 0.0 113.354 -169.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -89.36 135.23 31.42 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.972 1.309 . . . . 0.0 111.401 -174.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.55 142.43 17.98 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 123.78 2.987 . . . . 0.0 113.517 172.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.618 HD11 ' HA ' ' A' ' 10' ' ' ASN . 1.4 tm? -131.86 -47.12 0.94 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 110.993 -169.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.419 HD21 HE21 ' A' ' 134' ' ' GLN . 10.9 tp -144.64 156.61 44.19 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.069 1.748 . . . . 0.0 108.79 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 91.4 m -146.55 146.93 30.66 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 110.031 173.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.7 mp -123.49 146.99 47.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 127.431 2.293 . . . . 0.0 109.08 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 11.7 t -141.01 136.33 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.255 0.622 . . . . 0.0 111.912 -171.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.531 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.2 t -116.74 116.74 28.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.636 1.574 . . . . 0.0 110.594 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.8 p -78.19 -12.67 60.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.929 1.292 . . . . 0.0 114.295 173.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 131.7 -0.05 4.94 Favored Glycine 0 CA--C 1.538 1.494 0 C-N-CA 125.312 1.434 . . . . 0.0 114.701 -177.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.3 p -153.81 157.66 39.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.794 1.297 . . . . 0.0 113.648 -176.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -58.81 136.61 87.02 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 126.332 1.853 . . . . 0.0 115.135 177.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -96.14 176.27 10.26 Favored 'Cis proline' 0 CA--C 1.548 1.212 0 CA-C-N 120.193 1.105 . . . . 0.0 110.584 -11.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.21 153.18 44.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.93 -1.107 . . . . 0.0 111.73 169.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -81.14 170.47 16.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.118 1.367 . . . . 0.0 110.474 169.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.419 HE21 HD21 ' A' ' 122' ' ' LEU . 43.3 mt-30 -138.22 147.28 43.59 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.05 1.74 . . . . 0.0 111.391 176.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.5 t -150.41 150.12 30.96 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.552 1.541 . . . . 0.0 110.946 173.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.37 137.2 44.56 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 30.05 59.28 0.19 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.203 2.201 . . . . 0.0 115.565 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.255 23.4 ptt85 47.1 28.26 0.91 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 127.594 2.358 . . . . 0.0 117.215 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.41 -31.94 68.18 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.8 p -89.6 -2.12 58.22 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 173.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.3 86.33 19.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 125.436 1.494 . . . . 0.0 111.245 -169.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo . . . . . 0 C--O 1.25 1.09 0 C-N-CA 123.602 2.868 . . . . 0.0 113.102 169.872 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -65.4 -32.48 74.13 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.235 1.38 . . . . 0.0 112.613 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.11 -46.8 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.147 169.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.95 -41.98 99.67 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.024 0.829 . . . . 0.0 112.387 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -62.08 -47.52 84.28 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.763 0.825 . . . . 0.0 112.589 173.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.6 m -61.28 -52.01 66.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 122.868 0.467 . . . . 0.0 110.833 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -63.05 -34.69 78.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.404 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.62 67.84 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.657 1.571 . . . . 0.0 111.389 174.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -66.29 -42.62 88.11 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -60.52 -44.5 95.99 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.401 0.68 . . . . 0.0 112.15 171.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.9 m -57.64 -44.19 85.44 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.285 0.948 . . . . 0.0 111.424 174.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.4 -43.65 98.31 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.86 -44.05 94.29 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.645 -0.659 . . . . 0.0 112.246 175.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -65.43 -44.19 88.13 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.71 -0.619 . . . . 0.0 111.495 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.0 -41.73 92.73 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.529 0.732 . . . . 0.0 111.984 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.5 m -60.49 -42.97 97.4 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.069 0.85 . . . . 0.0 111.473 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.72 -40.71 92.47 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.833 -1.167 . . . . 0.0 113.225 173.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.97 -31.59 72.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.039 0.936 . . . . 0.0 113.005 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.0 tp -70.44 -36.85 74.19 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.789 1.236 . . . . 0.0 111.399 172.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -62.8 -44.88 94.99 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 121.056 -1.027 . . . . 0.0 111.8 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -54.07 -46.18 71.93 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.722 1.209 . . . . 0.0 111.796 170.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.49 -41.77 86.08 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 174.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.4 mt -62.41 -47.12 94.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 119.274 0.943 . . . . 0.0 110.512 173.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.05 -24.54 67.15 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.363 1.065 . . . . 0.0 113.775 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.06 -30.71 12.89 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -27.58 66.85 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 120.218 1.372 . . . . 0.0 113.691 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -74.13 -25.43 59.76 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.25 -27.45 13.19 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.38 1.072 . . . . 0.0 113.63 -173.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.7 m -86.84 -7.67 58.01 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.58 -3.06 80.5 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 124.592 1.091 . . . . 0.0 115.522 172.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -146.37 151.96 45.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 127.83 2.452 . . . . 0.0 107.294 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -42.12 153.01 0.14 Allowed 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 124.375 3.383 . . . . 0.0 115.303 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 74.3 t -110.78 162.51 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 126.331 1.852 . . . . 0.0 108.822 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.28 176.24 35.29 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 116.611 1.404 . . . . 0.0 116.611 -175.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 4.4 mp -135.24 131.01 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 125.378 1.471 . . . . 0.0 109.331 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -95.32 148.47 22.39 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.123 1.369 . . . . 0.0 110.928 173.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -138.79 143.36 38.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.079 1.752 . . . . 0.0 111.022 -173.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 77.8 p -142.05 176.37 9.01 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.734 1.614 . . . . 0.0 111.569 -173.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.94 -32.15 52.77 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.09 1.57 2.04 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -171.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.68 174.8 14.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.935 1.294 . . . . 0.0 112.598 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -143.02 159.99 41.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 127.044 2.138 . . . . 0.0 108.569 173.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -152.49 150.72 29.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.88 144.04 12.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.772 0.829 . . . . 0.0 110.431 176.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -135.39 147.89 49.19 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.754 1.622 . . . . 0.0 110.958 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.6 m -140.75 161.91 51.68 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 125.063 1.345 . . . . 0.0 110.875 -170.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -49.76 144.74 19.56 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.238 2.625 . . . . 0.0 114.751 177.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.39 -156.42 7.87 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.017 1.294 . . . . 0.0 114.145 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -53.46 -22.1 7.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -173.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.8 t -146.96 143.61 18.64 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.922 1.289 . . . . 0.0 112.158 -177.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.68 -10.98 12.94 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 123.66 2.907 . . . . 0.0 112.372 169.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.1 t -65.03 -25.31 67.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.948 1.299 . . . . 0.0 113.907 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.52 157.92 43.77 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.45 1.5 . . . . 0.0 111.209 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 44.3 t-105 -53.23 115.44 1.9 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.646 1.578 . . . . 0.0 112.079 177.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.4 tpp85 -155.89 152.22 28.03 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.241 1.416 . . . . 0.0 110.885 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -144.1 150.82 38.73 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 26.8 m -144.17 153.89 56.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 126.237 1.815 . . . . 0.0 110.191 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.31 147.84 72.85 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.137 1.891 . . . . 0.0 110.261 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.8 tp -78.16 52.98 1.15 Allowed 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.849 0.833 . . . . 0.0 111.037 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -128.83 18.71 6.15 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.442 1.497 . . . . 0.0 113.359 -169.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -63.14 -25.07 68.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.86 0.864 . . . . 0.0 113.052 172.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -149.46 -36.71 0.16 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.711 1.204 . . . . 0.0 113.406 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.74 29.46 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.645 1.578 . . . . 0.0 113.65 171.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.4 -37.63 49.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.177 1.791 . . . . 0.0 115.018 -169.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -103.59 12.09 35.37 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.466 1.507 . . . . 0.0 112.89 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -130.27 -33.74 1.68 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.752 1.221 . . . . 0.0 113.076 -172.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 75.2 m -75.63 9.15 2.41 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.186 1.394 . . . . 0.0 114.35 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -143.61 157.08 44.69 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.699 1.2 . . . . 0.0 112.67 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 40.64 -1.32 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 170.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.12 -27.83 69.35 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 121.652 2.024 . . . . 0.0 114.588 -173.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -70.06 -17.07 63.23 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.141 1.376 . . . . 0.0 113.91 -174.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -136.68 152.39 50.34 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.607 1.563 . . . . 0.0 114.161 -169.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -141.97 -6.77 0.96 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -141.98 18.34 2.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.06 1.344 . . . . 0.0 111.972 -169.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -125.9 154.88 42.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.57 1.148 . . . . 0.0 112.824 -169.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.1 m -127.47 145.37 50.86 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 127.52 2.328 . . . . 0.0 108.518 169.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -118.04 148.67 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.592 1.157 . . . . 0.0 111.108 -169.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -138.06 151.28 47.69 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.27 1.828 . . . . 0.0 109.664 172.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.2 tt -148.02 146.03 28.74 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.893 0.877 . . . . 0.0 111.439 -174.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.69 153.63 43.28 Favored Pre-proline 0 N--CA 1.472 0.646 0 C-N-CA 125.775 1.63 . . . . 0.0 111.227 176.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -81.48 -13.31 37.45 Favored 'Cis proline' 0 CA--C 1.543 0.926 0 CA-C-N 120.542 1.229 . . . . 0.0 114.426 0.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -63.46 142.75 58.28 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.78 1.232 . . . . 0.0 112.945 -176.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -59.56 112.99 6.03 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.024 1.73 . . . . 0.0 111.67 172.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -86.03 -178.78 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.228 2.618 . . . . 0.0 112.407 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.1 t70 70.96 -44.95 0.6 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 119.104 3.001 . . . . 0.0 119.104 168.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -138.77 12.7 2.7 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -170.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.6 t -56.93 150.54 16.45 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -74.08 -11.52 60.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.898 1.279 . . . . 0.0 113.252 171.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.13 162.37 58.04 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 125.354 1.462 . . . . 0.0 111.507 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -65.14 140.28 64.45 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.503 1.468 . . . . 0.0 110.306 169.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -71.01 -22.0 62.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.668 0.787 . . . . 0.0 112.509 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 62.1 t -116.33 128.19 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.883 0.873 . . . . 0.0 109.753 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.3 t -131.18 140.84 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.478 1.111 . . . . 0.0 110.554 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -126.53 124.24 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 126.575 1.95 . . . . 0.0 110.983 -169.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.7 mt -82.69 159.59 22.58 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.172 0.987 . . . . 0.0 112.041 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.35 -25.81 62.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.966 1.306 . . . . 0.0 114.345 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -87.64 -0.37 56.78 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 113.513 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.94 10.92 80.08 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.344 -0.847 . . . . 0.0 114.323 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -79.38 142.25 36.16 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.574 -0.957 . . . . 0.0 109.232 169.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -132.65 145.85 33.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 125.239 1.416 . . . . 0.0 109.094 -169.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.5 p -52.16 135.08 40.29 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 123.842 0.857 . . . . 0.0 112.286 169.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -70.78 123.48 9.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.763 2.309 . . . . 0.0 110.658 169.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.482 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 29.0 p90 -158.6 175.61 13.43 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.094 1.358 . . . . 0.0 112.14 175.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -137.68 144.72 41.94 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.227 1.411 . . . . 0.0 108.502 169.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.8 tp -136.85 116.15 12.63 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.658 1.983 . . . . 0.0 109.215 -169.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -110.42 146.35 36.02 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.953 1.301 . . . . 0.0 110.607 -175.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.4 mtt -126.11 138.24 53.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.773 1.629 . . . . 0.0 109.293 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -139.42 149.5 44.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.126 1.37 . . . . 0.0 111.69 -174.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -63.92 118.69 8.77 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.572 0.749 . . . . 0.0 110.699 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.29 -23.45 62.43 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -85.57 -17.69 61.6 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 123.873 0.749 . . . . 0.0 114.241 175.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.1 m -118.81 -24.55 6.6 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 118.21 1.005 . . . . 0.0 113.266 -169.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 64.29 33.82 88.27 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 123.604 0.621 . . . . 0.0 112.789 -171.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -125.93 127.04 24.84 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.59 1.556 . . . . 0.0 110.379 -170.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -51.74 148.01 23.02 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.204 3.269 . . . . 0.0 115.553 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.64 -51.76 1.93 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 127.101 2.16 . . . . 0.0 111.51 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -150.64 155.37 39.23 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.776 1.631 . . . . 0.0 108.637 -169.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.0 m -145.66 138.39 25.87 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 110.052 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.1 mp -111.2 149.22 31.27 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.363 2.265 . . . . 0.0 109.795 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 28.3 t -144.42 138.25 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.696 1.198 . . . . 0.0 111.871 -169.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.482 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 14.1 t -117.28 158.18 24.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.433 1.493 . . . . 0.0 112.125 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 83.0 p -133.06 -2.02 3.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.727 1.611 . . . . 0.0 114.311 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 125.3 -14.33 7.36 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.912 1.244 . . . . 0.0 115.101 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 55.7 m -142.35 152.55 43.01 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.826 1.251 . . . . 0.0 112.436 -172.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 47.5 t-105 -53.7 134.68 55.32 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.471 1.509 . . . . 0.0 114.678 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -99.9 178.2 6.05 Favored 'Cis proline' 0 CA--C 1.55 1.276 0 CA-C-N 120.53 1.225 . . . . 0.0 111.272 -11.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.461 HD21 ' CZ ' ' A' ' 108' ' ' PHE . 3.7 mp -67.76 168.6 11.11 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.191 -0.943 . . . . 0.0 112.079 169.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -114.08 164.6 13.61 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.389 1.475 . . . . 0.0 109.654 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -142.88 156.33 44.9 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.2 t -151.5 154.64 36.94 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.37 1.868 . . . . 0.0 111.084 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.01 133.82 47.64 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.494 -0.754 . . . . 0.0 109.047 169.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.82 63.1 0.13 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.646 1.978 . . . . 0.0 115.637 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 55.7 ptt85 46.46 25.77 0.43 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 127.83 2.452 . . . . 0.0 117.252 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.63 -33.62 71.74 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 -174.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.9 p -77.48 -20.95 53.59 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 20.1 mtp-105 -74.07 152.51 88.52 Favored Pre-proline 0 N--CA 1.475 0.795 0 C-N-CA 124.073 0.949 . . . . 0.0 112.768 -170.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 C--O 1.249 1.048 0 C-N-CA 123.788 2.992 . . . . 0.0 113.172 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.16 -36.43 79.79 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.126 1.33 . . . . 0.0 112.782 170.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.8 t -70.16 -41.84 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.62 0.768 . . . . 0.0 110.127 173.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.8 -39.88 95.65 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.666 -0.646 . . . . 0.0 112.586 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -62.01 -46.34 89.62 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.682 0.793 . . . . 0.0 111.804 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.0 m -55.75 -53.81 52.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.143 0.577 . . . . 0.0 110.73 174.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.1 mmt-85 -62.12 -36.11 80.77 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 117.488 -1.244 . . . . 0.0 112.661 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.1 66.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 121.103 1.774 . . . . 0.0 111.722 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -63.87 -42.39 97.54 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.063 1.345 . . . . 0.0 111.666 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -64.79 -44.72 89.02 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.775 1.63 . . . . 0.0 112.99 174.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -62.92 -38.68 91.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.388 1.075 . . . . 0.0 111.273 175.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.09 84.24 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.57 -43.75 98.28 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.705 -0.622 . . . . 0.0 111.954 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -61.05 -48.95 79.38 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.787 1.235 . . . . 0.0 111.446 177.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -61.02 -42.29 98.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.779 -0.629 . . . . 0.0 112.399 174.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.9 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.439 1.018 . . . . 0.0 111.013 176.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.31 -42.22 99.0 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.973 -1.079 . . . . 0.0 113.396 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.1 -33.78 76.55 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.228 -0.92 . . . . 0.0 112.882 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.7 tp -71.3 -31.89 67.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.875 1.27 . . . . 0.0 111.797 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -62.97 -44.57 95.68 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.07 -1.019 . . . . 0.0 110.69 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 tp -54.02 -46.57 71.85 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.805 1.242 . . . . 0.0 111.468 169.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.0 -45.31 90.96 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.1 mt -61.98 -46.22 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 110.863 175.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -62.74 -33.37 75.0 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.933 0.893 . . . . 0.0 113.025 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -82.06 -27.03 33.18 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.247 1.019 . . . . 0.0 113.562 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.08 -38.32 85.83 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.927 1.24 . . . . 0.0 114.26 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.6 t -68.82 -32.5 72.25 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.407 -0.808 . . . . 0.0 112.144 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.86 -32.96 59.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.383 1.473 . . . . 0.0 112.804 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 75.0 m -72.23 -24.58 61.4 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.516 1.526 . . . . 0.0 114.446 -174.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.27 13.2 64.54 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 123.749 0.69 . . . . 0.0 114.153 -174.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -152.96 150.61 24.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.893 2.877 . . . . 0.0 107.178 -178.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -50.24 161.36 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.616 2.211 . . . . 0.0 112.824 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.0 t -122.55 159.65 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 125.15 1.38 . . . . 0.0 108.214 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.86 -174.8 28.02 Favored Glycine 0 N--CA 1.464 0.563 0 O-C-N 120.603 -1.31 . . . . 0.0 115.155 -176.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -125.64 127.96 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.491 1.116 . . . . 0.0 108.963 174.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -97.71 98.12 9.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.575 1.55 . . . . 0.0 108.275 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -84.85 126.55 33.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.54 1.136 . . . . 0.0 109.162 171.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 87.9 p -126.34 9.17 7.23 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -175.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 64.66 -37.46 0.21 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 128.338 2.655 . . . . 0.0 114.84 -172.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -62.66 -40.89 98.48 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.197 1.399 . . . . 0.0 111.516 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.8 -174.66 4.03 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 128.061 2.545 . . . . 0.0 109.29 169.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -147.63 135.1 20.78 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.108 -0.995 . . . . 0.0 110.492 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.37 151.28 39.07 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.769 1.228 . . . . 0.0 112.383 -173.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.1 mt -71.54 149.19 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.546 0.738 . . . . 0.0 109.142 171.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 6.0 ttt -138.55 139.53 38.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.228 1.411 . . . . 0.0 110.3 -172.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.54 164.55 30.0 Favored Pre-proline 0 N--CA 1.479 1.023 0 C-N-CA 126.492 1.917 . . . . 0.0 111.286 -169.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -68.01 164.46 31.82 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 121.787 1.658 . . . . 0.0 111.791 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.63 -59.69 0.01 OUTLIER Glycine 0 N--CA 1.472 1.066 0 CA-C-O 119.568 -0.573 . . . . 0.0 114.183 177.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -65.81 -30.78 71.46 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.272 1.036 . . . . 0.0 113.763 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.5 t -157.11 138.71 9.89 Favored Pre-proline 0 N--CA 1.471 0.616 0 C-N-CA 124.608 1.163 . . . . 0.0 110.95 169.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -87.05 4.69 6.08 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.266 3.311 . . . . 0.0 113.399 171.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.2 p -45.72 -58.54 3.38 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -162.95 -36.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.126 1.371 . . . . 0.0 113.462 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -152.84 106.22 3.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.818 0.847 . . . . 0.0 112.118 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.1 tpp85 -155.9 151.58 27.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.338 1.855 . . . . 0.0 109.607 169.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -144.54 135.83 25.36 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.7 m -143.01 151.64 56.5 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 128.255 2.622 . . . . 0.0 108.953 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.06 135.28 40.02 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 122.222 1.948 . . . . 0.0 111.095 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 tt -71.63 88.55 0.96 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.539 1.136 . . . . 0.0 109.317 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -135.74 -10.51 2.09 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -58.54 -27.68 64.76 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.651 1.114 . . . . 0.0 113.845 -177.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -135.94 24.56 3.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.454 1.902 . . . . 0.0 112.776 174.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.56 35.37 2.46 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.856 2.062 . . . . 0.0 109.718 172.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.72 118.58 4.34 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.049 1.74 . . . . 0.0 112.648 -169.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.1 t70 54.32 21.77 3.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.886 1.674 . . . . 0.0 115.101 -177.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -133.69 -12.18 2.66 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.9 t -63.87 -24.46 67.75 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.242 1.017 . . . . 0.0 113.551 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -151.6 165.61 33.77 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.762 1.225 . . . . 0.0 113.269 -177.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.74 -37.13 0.06 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 129.398 3.079 . . . . 0.0 116.66 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.91 -6.58 22.61 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.016 2.126 . . . . 0.0 113.935 173.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -42.97 -48.45 5.93 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.395 1.878 . . . . 0.0 114.574 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -158.16 -178.41 7.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.142 1.377 . . . . 0.0 112.549 -169.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -139.12 18.17 2.61 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.116 1.366 . . . . 0.0 112.922 171.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -146.93 -2.99 0.6 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.0 mt -118.08 160.08 22.12 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 -169.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.5 t -132.74 133.72 43.84 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.93 2.492 . . . . 0.0 107.802 169.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -109.66 145.62 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.542 1.137 . . . . 0.0 111.038 -169.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -136.99 155.2 50.01 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.965 1.706 . . . . 0.0 110.713 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.2 tt -145.62 147.36 31.95 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.604 1.161 . . . . 0.0 112.523 -169.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' N ' HD23 ' A' ' 84' ' ' LEU . 5.0 pp0? -154.03 153.44 28.49 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.282 1.833 . . . . 0.0 109.607 168.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -76.5 -13.62 27.25 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 120.84 1.336 . . . . 0.0 113.938 -2.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -67.85 173.15 4.64 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.339 1.056 . . . . 0.0 111.953 171.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.13 135.06 26.84 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.725 1.21 . . . . 0.0 112.449 -173.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.89 100.05 1.34 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.474 2.783 . . . . 0.0 109.87 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -159.93 141.85 13.02 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.321 1.449 . . . . 0.0 110.571 -171.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -59.83 87.05 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.736 1.214 . . . . 0.0 112.131 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.4 m -101.93 -6.57 23.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.361 1.864 . . . . 0.0 113.085 -169.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.0 20.97 4.63 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.729 2.011 . . . . 0.0 114.277 -177.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -157.29 163.47 24.83 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 127.244 2.218 . . . . 0.0 108.624 175.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.58 155.63 66.01 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 CA-C-N 120.26 1.129 . . . . 0.0 110.883 169.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -107.2 -44.88 4.25 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.088 0.555 . . . . 0.0 110.826 170.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.0 t -79.47 132.47 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.8 t -134.08 145.29 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.997 0.919 . . . . 0.0 111.865 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.72 131.53 72.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 C-N-CA 129.644 3.178 . . . . 0.0 107.984 -172.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.8 mt -96.43 157.72 15.77 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.279 0.562 . . . . 0.0 111.151 169.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.64 -22.73 47.29 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.28 -18.62 61.78 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.802 1.641 . . . . 0.0 113.507 174.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.36 5.18 63.75 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 124.933 1.254 . . . . 0.0 114.611 -176.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.29 144.25 29.84 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 118.323 1.062 . . . . 0.0 108.99 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 3.8 mm -131.47 150.27 34.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 125.334 1.454 . . . . 0.0 110.088 -168.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.6 p -57.59 121.91 52.13 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.685 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.36 127.98 28.22 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 122.736 2.29 . . . . 0.0 113.373 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -161.48 175.17 12.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.069 1.348 . . . . 0.0 112.558 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 79.1 p -136.42 150.02 48.56 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 123.749 0.82 . . . . 0.0 111.044 168.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.0 tp -130.38 106.35 8.49 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.795 2.038 . . . . 0.0 108.041 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -98.48 145.46 26.75 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.924 1.29 . . . . 0.0 110.022 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.2 mtt -128.67 128.96 45.13 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.905 1.682 . . . . 0.0 108.895 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.7 144.28 50.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 124.99 1.316 . . . . 0.0 110.764 -178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -69.61 104.54 2.4 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.089 1.356 . . . . 0.0 110.004 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.62 -20.98 66.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.625 1.17 . . . . 0.0 114.132 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -99.14 -7.19 55.2 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.775 1.179 . . . . 0.0 114.818 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.2 m -124.17 -29.11 3.62 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.579 1.152 . . . . 0.0 112.327 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 103.24 22.66 9.01 Favored Glycine 0 CA--C 1.534 1.275 0 N-CA-C 116.659 1.424 . . . . 0.0 116.659 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -140.18 143.46 33.8 Favored Pre-proline 0 N--CA 1.477 0.887 0 CA-C-N 119.491 1.645 . . . . 0.0 112.972 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.67 147.86 29.74 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.784 2.989 . . . . 0.0 113.503 169.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.87 -47.49 1.14 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.156 1.382 . . . . 0.0 112.513 -169.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -151.65 154.21 35.94 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.973 1.309 . . . . 0.0 108.954 -174.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 57.9 m -146.07 141.39 27.55 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 120.896 -1.127 . . . . 0.0 110.26 176.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.9 mp -113.35 148.95 34.73 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 126.589 1.955 . . . . 0.0 108.911 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.2 t -141.57 137.2 32.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.444 0.698 . . . . 0.0 111.875 -173.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.76 113.98 21.45 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.152 1.381 . . . . 0.0 110.94 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.7 m -75.52 -12.85 60.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 139.91 -3.09 2.5 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.851 1.215 . . . . 0.0 115.547 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 9.5 t -151.81 153.43 34.23 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.306 1.553 . . . . 0.0 112.87 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.5 t-105 -59.97 141.48 89.78 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 126.145 1.778 . . . . 0.0 115.244 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -91.44 176.05 17.44 Favored 'Cis proline' 0 CA--C 1.544 0.992 0 CA-C-N 119.793 0.962 . . . . 0.0 110.88 -11.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -67.96 152.69 45.14 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 122.226 1.012 . . . . 0.0 111.906 170.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.96 169.38 16.85 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.169 1.387 . . . . 0.0 109.523 169.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -137.51 147.21 45.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.339 1.456 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.2 t -152.13 154.57 36.14 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.247 1.419 . . . . 0.0 110.992 174.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.97 133.84 41.62 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 31.77 61.37 0.29 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.752 2.021 . . . . 0.0 115.551 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.305 0.0 OUTLIER 49.64 11.3 0.05 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 128.528 2.731 . . . . 0.0 118.209 -176.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.18 -34.07 63.54 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 3.2 m -91.68 -10.15 41.26 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.484 1.113 . . . . 0.0 113.288 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -64.97 -41.54 55.5 Favored Pre-proline 0 N--CA 1.478 0.961 0 CA-C-O 116.508 -1.711 . . . . 0.0 115.029 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo . . . . . 0 C--O 1.25 1.114 0 C-N-CA 124.317 3.345 . . . . 0.0 115.349 176.558 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -153.74 -30.69 0.12 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.54 1.536 . . . . 0.0 112.594 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.75 -29.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -43.09 -53.24 5.02 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 117.299 2.333 . . . . 0.0 117.299 -167.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 121' ' ' LEU . 18.6 t-20 -65.51 -21.11 66.59 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.7 m -93.43 -51.95 4.74 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.221 1.409 . . . . 0.0 110.487 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 tpt85 -59.23 -33.81 71.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.012 2.125 . . . . 0.0 113.091 -177.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.05 95.11 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.434 1.47 . . . . 0.0 112.597 173.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -67.04 -41.67 86.15 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.464 1.106 . . . . 0.0 110.871 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.07 -41.46 99.44 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.635 0.774 . . . . 0.0 112.168 172.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.6 m -61.13 -41.6 97.02 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.406 1.082 . . . . 0.0 111.184 175.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.09 -41.14 91.07 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.54 91.52 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.517 -0.739 . . . . 0.0 111.884 173.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -58.47 -46.99 85.5 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.299 1.439 . . . . 0.0 111.038 174.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -63.58 -42.88 98.26 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.44 1.096 . . . . 0.0 112.688 177.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.7 m -61.7 -44.73 96.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 118.727 0.694 . . . . 0.0 110.864 176.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.25 -41.79 98.76 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.144 -0.972 . . . . 0.0 113.082 173.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.09 -31.33 70.87 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.263 -0.898 . . . . 0.0 113.374 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.6 tp -71.15 -32.79 69.37 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.482 1.113 . . . . 0.0 111.414 171.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.54 -44.01 95.45 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.913 -1.117 . . . . 0.0 110.644 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -44.75 68.34 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.048 1.339 . . . . 0.0 111.236 169.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.79 -40.63 97.93 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 176.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -64.09 -44.99 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.744 0.817 . . . . 0.0 110.718 173.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -60.6 -39.37 87.89 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.347 0.659 . . . . 0.0 112.56 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -32.82 63.18 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.378 -0.826 . . . . 0.0 112.126 174.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -36.29 83.38 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 120.121 1.328 . . . . 0.0 112.48 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -21.92 60.46 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.902 -0.499 . . . . 0.0 112.268 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.38 -28.79 14.3 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.638 1.175 . . . . 0.0 113.216 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.5 m -77.55 -28.87 52.0 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -172.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.42 9.32 84.46 Favored Glycine 0 CA--C 1.542 1.771 0 CA-C-N 119.12 0.873 . . . . 0.0 114.629 -172.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -140.76 144.34 35.51 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 127.89 2.476 . . . . 0.0 106.637 169.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.71 158.61 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.651 2.901 . . . . 0.0 114.785 169.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.0 t -115.57 164.92 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.867 2.067 . . . . 0.0 108.204 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -155.99 174.53 33.91 Favored Glycine 0 N--CA 1.465 0.611 0 CA-C-N 120.402 1.456 . . . . 0.0 115.788 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 138.04 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.55 1.14 . . . . 0.0 108.773 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -114.89 125.59 53.82 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.109 2.163 . . . . 0.0 109.299 -169.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -127.26 127.1 43.85 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 110.895 -171.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.5 t -147.19 167.08 25.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.028 1.331 . . . . 0.0 112.053 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.33 -28.02 67.63 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.409 1.083 . . . . 0.0 112.697 173.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 p -71.88 -54.19 10.84 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.034 1.334 . . . . 0.0 112.58 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.66 173.4 13.94 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.356 2.262 . . . . 0.0 110.336 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -136.25 153.36 51.22 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.939 0.896 . . . . 0.0 111.508 169.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.8 ptp85 -158.28 163.21 37.61 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.822 1.249 . . . . 0.0 113.955 -170.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.9 mt -92.91 144.89 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.929 0.891 . . . . 0.0 109.724 170.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 92.0 mtp -134.45 149.79 50.78 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.964 1.706 . . . . 0.0 110.645 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.0 p -141.62 156.07 66.54 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.979 1.711 . . . . 0.0 111.299 -168.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -58.31 -29.99 89.65 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.085 2.523 . . . . 0.0 114.066 169.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 67.4 -68.47 0.25 Allowed Glycine 0 CA--C 1.529 0.942 0 C-N-CA 127.466 2.46 . . . . 0.0 115.496 169.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -135.6 -20.75 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.345 1.858 . . . . 0.0 114.436 -169.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.48 48.01 3.04 Favored Pre-proline 0 N--CA 1.485 1.281 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -169.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -65.82 4.69 0.79 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 123.973 3.115 . . . . 0.0 114.741 178.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.0 m -44.88 -33.79 2.1 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 129.184 2.994 . . . . 0.0 115.573 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -154.04 -51.65 0.1 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.552 1.141 . . . . 0.0 111.749 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.8 t-105 -158.91 125.3 4.58 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.478 1.511 . . . . 0.0 110.468 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -152.65 154.13 34.71 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.234 1.413 . . . . 0.0 111.14 174.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -141.87 151.0 42.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.823 1.249 . . . . 0.0 112.534 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.3 p -159.45 149.54 15.16 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 127.992 2.517 . . . . 0.0 108.12 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.28 140.22 42.77 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.577 2.185 . . . . 0.0 112.813 169.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.74 64.27 2.98 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.272 1.029 . . . . 0.0 110.371 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -131.05 5.65 4.53 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.658 1.583 . . . . 0.0 113.086 -170.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -62.03 -18.21 59.84 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.655 1.182 . . . . 0.0 113.961 176.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -133.85 -33.09 1.07 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.162 1.385 . . . . 0.0 113.026 173.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.82 -11.94 61.05 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 174.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.32 -55.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 129.934 3.294 . . . . 0.0 116.574 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.5 -15.15 0.24 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.778 1.631 . . . . 0.0 113.894 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -62.42 -21.29 65.29 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 120.801 -1.187 . . . . 0.0 114.085 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.0 m -76.65 -2.3 32.02 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.455 1.502 . . . . 0.0 114.735 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -141.22 165.42 27.58 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.107 1.322 . . . . 0.0 112.863 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 41.2 t30 47.73 -52.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 130.362 3.465 . . . . 0.0 119.684 169.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -55.46 -13.68 1.61 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 127.412 2.285 . . . . 0.0 113.442 169.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 28.6 m95 -43.07 -30.26 0.42 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 115.604 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -149.17 154.88 39.81 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.928 1.24 . . . . 0.0 112.972 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -145.62 -19.64 0.47 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -177.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -136.99 16.35 3.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.548 1.539 . . . . 0.0 111.311 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -129.61 156.45 44.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.944 1.698 . . . . 0.0 110.532 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.2 m -125.44 130.65 52.26 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.288 1.835 . . . . 0.0 109.013 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.97 139.3 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.594 1.158 . . . . 0.0 110.06 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 -137.48 122.18 18.64 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.505 1.522 . . . . 0.0 109.357 -176.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.15 145.11 42.1 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.972 1.309 . . . . 0.0 111.994 -169.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -156.62 153.48 24.78 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.364 1.865 . . . . 0.0 110.19 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -75.02 -15.22 22.56 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 CA-C-N 120.347 1.16 . . . . 0.0 113.69 -3.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -61.06 125.57 24.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.202 1.001 . . . . 0.0 111.801 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 134.72 89.61 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 124.183 0.993 . . . . 0.0 112.52 177.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.98 108.64 2.36 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.049 2.5 . . . . 0.0 109.627 172.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -159.51 145.93 16.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.473 1.109 . . . . 0.0 111.851 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.85 48.22 0.46 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.446 1.498 . . . . 0.0 112.618 174.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.8 m -58.31 156.18 10.44 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.903 1.681 . . . . 0.0 113.207 -176.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -67.8 5.09 0.93 Allowed 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -159.45 164.35 20.82 Favored Pre-proline 0 CA--C 1.542 0.649 0 C-N-CA 127.346 2.258 . . . . 0.0 109.889 -176.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.89 149.68 83.13 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 121.407 1.405 . . . . 0.0 110.01 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -94.1 -42.81 8.8 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.039 -0.413 . . . . 0.0 111.987 176.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -73.79 138.53 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.227 1.011 . . . . 0.0 109.194 169.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 85.5 t -136.13 144.94 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.717 0.807 . . . . 0.0 111.772 -176.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.45 118.0 48.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 128.885 2.874 . . . . 0.0 108.072 -173.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.7 mt -82.53 163.41 21.54 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 122.275 1.036 . . . . 0.0 111.952 177.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.88 -13.69 11.99 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -176.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -120.12 9.44 11.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.561 . . . . 0.0 113.308 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.31 9.25 58.12 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 115.788 1.075 . . . . 0.0 115.788 174.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -75.49 136.56 40.63 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.942 1.371 . . . . 0.0 108.178 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.2 mm -130.14 144.69 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.706 1.203 . . . . 0.0 109.551 -172.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.6 p -54.75 133.56 65.44 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 121.656 -0.653 . . . . 0.0 110.931 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.49 98.49 1.18 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.506 2.137 . . . . 0.0 111.466 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 22.4 p90 -124.48 177.28 6.0 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.045 1.738 . . . . 0.0 111.945 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.2 t -140.26 145.57 37.49 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.802 1.241 . . . . 0.0 110.299 172.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 7.7 tp -130.45 92.14 3.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.128 2.171 . . . . 0.0 109.602 -169.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.1 tt -80.75 143.73 32.69 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.962 0.905 . . . . 0.0 109.921 176.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 63.2 mtt -127.31 133.11 50.15 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 126.028 1.731 . . . . 0.0 108.309 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.46 143.49 51.17 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.907 1.283 . . . . 0.0 110.693 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -66.92 109.46 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.764 0.826 . . . . 0.0 110.901 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.37 64.57 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.88 -0.04 75.57 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 125.653 1.597 . . . . 0.0 114.429 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -129.85 -37.45 1.53 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.704 1.201 . . . . 0.0 113.143 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 88.49 30.18 16.82 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 118.515 0.598 . . . . 0.0 114.014 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -141.65 139.67 18.95 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.123 1.369 . . . . 0.0 111.225 -169.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -49.61 144.63 18.93 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.912 3.075 . . . . 0.0 114.182 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.466 HD11 ' HA ' ' A' ' 10' ' ' ASN . 1.5 tm? -130.68 -50.08 1.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 110.603 -169.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.47 162.84 33.48 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.74 1.616 . . . . 0.0 110.174 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 9.4 m -147.99 117.51 7.01 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 123.882 0.873 . . . . 0.0 109.188 176.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.5 mp -92.4 149.51 21.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.8 1.24 . . . . 0.0 109.918 173.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.07 136.45 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.417 1.087 . . . . 0.0 112.056 -169.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 18.0 t -120.62 160.26 23.61 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.905 1.682 . . . . 0.0 111.442 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 82.1 p -137.72 -0.4 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -174.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.34 -11.6 5.8 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.613 1.102 . . . . 0.0 115.004 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.2 p -157.6 158.67 36.0 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.235 -1.156 . . . . 0.0 113.513 -173.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 131' ' ' PRO . 29.6 t-105 -60.69 140.11 92.95 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 126.309 1.843 . . . . 0.0 114.991 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 130' ' ' TRP . 42.6 Cg_endo -96.1 176.98 9.71 Favored 'Cis proline' 0 CA--C 1.546 1.114 0 CA-C-N 119.969 1.025 . . . . 0.0 111.281 -11.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.9 mp -69.35 168.14 14.98 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.133 0.968 . . . . 0.0 111.096 169.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -114.71 164.29 14.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.158 1.383 . . . . 0.0 109.434 169.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -140.46 149.83 43.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.362 1.065 . . . . 0.0 112.484 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.1 t -145.62 150.28 36.06 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.149 1.38 . . . . 0.0 111.181 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.85 132.19 46.35 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.781 -0.574 . . . . 0.0 109.478 169.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.91 66.37 0.07 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.472 2.309 . . . . 0.0 115.939 176.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.76 7.81 4.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 175.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -57.74 -31.28 66.32 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 116.31 1.967 . . . . 0.0 116.31 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.9 p -99.09 -6.33 28.59 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -63.64 -35.77 18.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 117.277 2.325 . . . . 0.0 117.277 -169.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo . . . . . 0 C--O 1.25 1.094 0 C-N-CA 124.111 3.207 . . . . 0.0 115.307 177.865 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 . . . . . 0 CA--C 1.541 0.607 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -71.12 -41.11 70.95 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.836 1.198 . . . . 0.0 112.767 176.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 46.4 t -66.96 -45.01 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.693 0.797 . . . . 0.0 109.825 173.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.69 90.83 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.105 0.962 . . . . 0.0 112.512 176.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -63.11 -49.28 75.03 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.749 1.159 . . . . 0.0 111.671 172.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.2 m -57.77 -52.41 65.59 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.136 0.574 . . . . 0.0 110.584 177.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -65.48 -30.75 71.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.685 1.194 . . . . 0.0 113.728 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.35 -48.75 78.43 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.743 1.61 . . . . 0.0 110.778 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -66.41 -38.94 88.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.887 1.275 . . . . 0.0 111.513 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.53 -46.06 87.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.612 0.765 . . . . 0.0 112.191 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.3 m -57.56 -40.08 78.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.857 0.863 . . . . 0.0 111.27 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.06 -44.58 84.11 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.46 -43.51 97.15 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.357 -0.839 . . . . 0.0 111.913 174.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -62.15 -45.56 92.91 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.948 1.699 . . . . 0.0 111.515 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -59.13 -47.46 85.21 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.463 1.105 . . . . 0.0 112.242 170.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.5 m -58.24 -41.56 84.45 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 118.871 0.759 . . . . 0.0 110.725 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.32 -41.02 94.44 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.051 -1.031 . . . . 0.0 113.715 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.23 -32.78 74.5 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.148 -0.97 . . . . 0.0 113.094 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.3 tp -74.08 -35.11 64.2 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.848 1.259 . . . . 0.0 111.602 174.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.53 -46.25 90.75 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.994 -1.066 . . . . 0.0 111.067 169.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 tp -51.98 -47.45 64.85 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.322 1.449 . . . . 0.0 111.262 169.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.43 85.93 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.9 mt -66.05 -47.95 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.411 1.005 . . . . 0.0 110.659 174.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -59.83 -39.24 84.4 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.807 -0.558 . . . . 0.0 112.007 175.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -69.17 -38.72 78.86 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.362 -0.836 . . . . 0.0 112.391 175.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.26 73.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.449 1.022 . . . . 0.0 112.712 174.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.08 -20.41 55.79 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.687 0.676 . . . . 0.0 112.551 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.48 -27.19 14.17 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.613 1.165 . . . . 0.0 113.702 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.7 m -89.83 -14.03 35.28 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -169.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.34 -1.36 81.67 Favored Glycine 0 CA--C 1.542 1.723 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -140.83 149.98 58.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 127.861 2.464 . . . . 0.0 107.25 172.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -45.95 164.67 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 124.305 3.337 . . . . 0.0 115.528 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.8 t -123.12 159.3 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.431 1.893 . . . . 0.0 108.353 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.35 -178.79 32.71 Favored Glycine 0 N--CA 1.465 0.574 0 O-C-N 120.721 -1.237 . . . . 0.0 115.402 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.8 mt -131.27 111.95 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.42 1.088 . . . . 0.0 110.333 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -83.36 78.29 9.66 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.206 1.803 . . . . 0.0 110.269 175.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -64.99 120.36 12.46 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 168.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 t -125.99 -179.6 4.77 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.25 1.42 . . . . 0.0 113.079 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.34 -24.78 68.0 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -169.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.1 m -135.08 -9.72 2.29 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -175.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -161.16 -175.68 5.01 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.959 2.104 . . . . 0.0 109.365 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -136.6 151.48 49.38 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.302 1.041 . . . . 0.0 109.583 169.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -141.08 151.34 43.92 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.2 mm -76.65 137.33 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 169.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.1 mtm -128.89 150.4 50.37 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.049 1.34 . . . . 0.0 111.371 175.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.65 163.28 51.74 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 126.98 2.112 . . . . 0.0 111.261 -168.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -54.49 160.95 6.24 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 124.085 3.19 . . . . 0.0 114.825 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -120.22 -136.35 5.17 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.587 1.089 . . . . 0.0 113.715 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -46.54 -35.79 6.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 126.37 1.868 . . . . 0.0 114.68 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 t -146.45 142.13 17.09 Favored Pre-proline 0 N--CA 1.47 0.572 0 C-N-CA 124.805 1.242 . . . . 0.0 111.696 174.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.6 -10.0 14.59 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.488 2.792 . . . . 0.0 112.55 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 t -71.13 -17.3 62.57 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.057 1.343 . . . . 0.0 114.157 -173.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.62 163.7 33.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.489 1.516 . . . . 0.0 111.611 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.0 t-105 -58.32 112.4 1.55 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.844 1.257 . . . . 0.0 111.911 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.1 tpt85 -157.04 143.18 17.96 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.699 1.599 . . . . 0.0 109.992 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -136.52 153.63 50.96 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.553 1.141 . . . . 0.0 112.81 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.4 t -150.3 140.33 13.86 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 128.079 2.552 . . . . 0.0 108.366 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -51.46 145.32 29.1 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.474 2.116 . . . . 0.0 111.787 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.4 tp -66.44 12.7 0.06 Allowed 'General case' 0 CA--C 1.554 1.134 0 O-C-N 120.576 -1.328 . . . . 0.0 114.185 176.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -64.93 -7.77 12.9 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.998 -1.688 . . . . 0.0 113.576 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -57.46 -25.78 60.23 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.031 1.333 . . . . 0.0 112.122 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -137.21 -42.19 0.57 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.607 1.163 . . . . 0.0 112.964 170.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.35 48.3 1.01 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.014 1.325 . . . . 0.0 111.492 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.31 -34.66 10.88 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.707 1.603 . . . . 0.0 115.099 -169.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -123.92 13.5 9.16 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.743 2.017 . . . . 0.0 113.286 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -133.39 -5.16 2.97 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.242 1.417 . . . . 0.0 113.942 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.0 t -54.88 -34.29 62.83 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.263 1.025 . . . . 0.0 112.819 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -118.91 140.21 50.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.62 1.568 . . . . 0.0 112.506 178.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 23.83 -115.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 127.429 2.292 . . . . 0.0 114.152 -169.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.0 t70 54.41 29.92 11.84 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.351 1.46 . . . . 0.0 113.718 -169.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -115.85 -21.25 9.66 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.972 1.709 . . . . 0.0 113.21 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -141.6 170.65 15.33 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.952 1.301 . . . . 0.0 113.537 -175.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -143.0 8.24 1.65 Allowed 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 169.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.36 9.41 1.08 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 125.053 1.341 . . . . 0.0 114.213 -175.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.96 160.86 23.96 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.414 -1.429 . . . . 0.0 112.097 -169.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.6 m -128.78 134.47 48.4 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 126.759 2.024 . . . . 0.0 108.825 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -104.61 146.98 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 124.292 1.037 . . . . 0.0 110.226 -173.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -138.18 160.9 38.21 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.663 1.985 . . . . 0.0 109.81 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.97 160.84 28.93 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.664 1.186 . . . . 0.0 112.424 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -148.0 130.58 7.8 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.948 2.099 . . . . 0.0 108.284 176.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -79.0 -5.21 37.48 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 CA-C-N 121.671 1.633 . . . . 0.0 113.146 -10.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -65.99 -178.83 0.65 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.177 1.791 . . . . 0.0 112.724 176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.6 138.87 25.44 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 124.485 1.114 . . . . 0.0 112.897 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.72 99.88 1.2 Allowed 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.72 2.947 . . . . 0.0 109.704 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -156.46 154.39 30.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.663 1.185 . . . . 0.0 111.67 -169.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -76.06 53.08 0.76 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.925 1.69 . . . . 0.0 113.51 -171.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 84.0 p -67.38 -12.85 61.25 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.426 1.49 . . . . 0.0 114.119 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.9 25.81 14.98 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.406 1.883 . . . . 0.0 113.2 -175.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -144.18 164.42 29.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 125.419 1.488 . . . . 0.0 110.299 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -64.84 141.22 70.57 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 CA-C-N 120.057 1.056 . . . . 0.0 111.951 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -89.21 -25.83 21.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.931 0.892 . . . . 0.0 110.96 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.5 t -123.98 134.91 65.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.691 1.996 . . . . 0.0 108.324 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.3 t -132.82 145.48 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.972 0.909 . . . . 0.0 111.36 -171.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.0 120.13 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.377 2.671 . . . . 0.0 108.422 -169.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.2 mt -85.54 164.21 17.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.253 1.025 . . . . 0.0 112.058 177.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.02 -13.79 13.22 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -175.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -120.32 9.79 11.1 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.48 1.512 . . . . 0.0 113.354 -177.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.96 9.02 58.71 Favored Glycine 0 CA--C 1.533 1.212 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 174.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.13 136.49 41.09 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.815 1.307 . . . . 0.0 108.438 169.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.21 142.59 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.915 1.286 . . . . 0.0 109.169 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.6 p -54.02 127.31 54.04 Favored Pre-proline 0 N--CA 1.472 0.655 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.232 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.34 122.78 8.98 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.535 2.157 . . . . 0.0 111.423 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.524 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 3.3 p90 -159.03 -179.27 7.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.925 2.09 . . . . 0.0 110.594 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -140.85 99.39 3.6 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 172.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.4 tp -57.73 127.93 34.53 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.369 2.268 . . . . 0.0 109.418 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -125.58 150.53 47.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.059 1.344 . . . . 0.0 110.546 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.3 mtt -133.06 144.74 50.21 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.42 -176.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.61 147.62 43.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.32 1.448 . . . . 0.0 111.317 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -65.86 121.43 15.03 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.982 0.913 . . . . 0.0 110.506 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.62 -18.91 64.41 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 176.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -72.07 -65.51 2.35 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.611 1.1 . . . . 0.0 113.166 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 38.5 p -83.83 -26.1 29.8 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 83.87 -0.1 89.59 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.142 1.353 . . . . 0.0 113.874 -170.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -80.09 145.91 61.91 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-N 118.705 1.253 . . . . 0.0 112.403 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.39 151.24 80.63 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.932 2.421 . . . . 0.0 112.007 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.61 -47.47 1.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.827 1.651 . . . . 0.0 112.619 -169.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.498 HD21 HE21 ' A' ' 134' ' ' GLN . 8.0 tp -151.94 156.2 39.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.951 1.3 . . . . 0.0 109.813 -169.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -146.69 139.31 25.11 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.384 1.074 . . . . 0.0 109.149 174.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.0 131.65 56.88 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.134 1.774 . . . . 0.0 108.285 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.9 t -118.95 139.83 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.456 1.502 . . . . 0.0 111.214 -169.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.524 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.7 t -123.21 144.59 49.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.031 1.732 . . . . 0.0 111.255 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.0 m -129.42 8.77 5.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.724 1.21 . . . . 0.0 113.712 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.89 -12.8 4.47 Favored Glycine 0 CA--C 1.537 1.424 0 N-CA-C 115.71 1.044 . . . . 0.0 115.71 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 87.7 p -157.78 159.71 37.05 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.057 1.428 . . . . 0.0 114.128 -173.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 35.0 t-105 -60.67 139.9 92.93 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 127.068 2.147 . . . . 0.0 115.803 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -95.9 179.01 8.47 Favored 'Cis proline' 0 CA--C 1.547 1.168 0 CA-C-N 120.05 1.053 . . . . 0.0 110.828 -11.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -72.3 165.35 24.65 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.15 -0.969 . . . . 0.0 112.251 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -118.71 129.49 55.31 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.891 1.676 . . . . 0.0 111.58 -176.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.498 HE21 HD21 ' A' ' 122' ' ' LEU . 51.7 tt0 -92.61 143.96 25.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.375 1.87 . . . . 0.0 112.582 -169.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.3 t -150.39 159.34 44.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.195 1.798 . . . . 0.0 110.924 171.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -78.85 134.45 36.94 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.366 -0.834 . . . . 0.0 109.014 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.18 60.13 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.939 2.096 . . . . 0.0 115.589 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 39.4 ptt180 44.68 27.29 0.24 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.874 2.87 . . . . 0.0 117.405 -176.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -57.94 -30.42 65.95 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 40.7 p -79.87 -15.24 57.75 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 174.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -72.01 -39.3 6.65 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo . . . . . 0 C--O 1.25 1.103 0 C-N-CA 124.297 3.331 . . . . 0.0 115.222 176.047 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -66.11 -41.9 89.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.044 0.937 . . . . 0.0 112.432 171.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.02 -46.83 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 118.381 -0.819 . . . . 0.0 109.409 170.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.91 90.71 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.559 1.072 . . . . 0.0 113.028 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -61.82 -48.72 79.33 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.436 1.016 . . . . 0.0 111.818 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 m -57.66 -47.62 81.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.905 0.482 . . . . 0.0 111.12 176.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.72 -34.25 77.42 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.109 1.764 . . . . 0.0 112.424 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.41 ' HA ' HD11 ' A' ' 80' ' ' LEU . . . -61.82 -46.51 89.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.62 1.1 . . . . 0.0 111.534 169.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.61 -37.47 86.71 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.248 1.019 . . . . 0.0 111.663 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -65.44 -46.57 79.37 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.056 0.942 . . . . 0.0 112.238 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 84.8 m -60.34 -35.06 74.78 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.326 1.05 . . . . 0.0 111.803 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.55 73.4 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.025 1.33 . . . . 0.0 113.48 174.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -44.05 97.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.6 -0.687 . . . . 0.0 111.518 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -59.79 -48.54 81.28 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.6 1.16 . . . . 0.0 111.854 173.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -58.39 -44.6 89.0 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.134 0.879 . . . . 0.0 112.183 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 29.8 m -61.25 -43.03 99.55 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.493 0.588 . . . . 0.0 110.797 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.45 93.67 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.073 -1.017 . . . . 0.0 113.429 172.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.62 76.33 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.123 0.969 . . . . 0.0 112.779 175.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.3 tp -72.94 -34.64 66.69 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.756 1.223 . . . . 0.0 111.537 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.33 -45.33 93.72 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.049 -1.032 . . . . 0.0 110.833 169.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.33 -45.78 55.13 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.869 1.668 . . . . 0.0 111.178 169.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.51 96.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.91 -48.67 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.836 0.744 . . . . 0.0 110.427 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.25 -29.15 69.66 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.572 1.149 . . . . 0.0 113.167 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -87.01 -37.53 17.41 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.068 0.947 . . . . 0.0 113.082 177.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.22 -33.23 71.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.306 1.042 . . . . 0.0 113.623 -177.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 t -74.17 -13.87 60.87 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.6 mt -110.26 -35.96 5.94 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 113.536 -173.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.3 p -70.24 -35.24 73.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.908 1.283 . . . . 0.0 113.703 -177.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.26 0.8 50.84 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.406 1.479 . . . . 0.0 114.699 -175.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -144.67 147.6 36.48 Favored Pre-proline 0 N--CA 1.473 0.68 0 C-N-CA 125.243 1.417 . . . . 0.0 110.08 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -46.78 152.71 1.57 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 122.608 2.205 . . . . 0.0 112.116 167.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.23 160.65 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.417 1.487 . . . . 0.0 108.455 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.66 175.97 28.57 Favored Glycine 0 CA--C 1.522 0.482 0 O-C-N 120.886 -1.134 . . . . 0.0 114.53 -176.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.4 mt -135.72 127.65 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.603 1.161 . . . . 0.0 108.728 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -99.95 130.66 46.15 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.272 1.829 . . . . 0.0 109.587 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -118.61 121.71 40.85 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.055 1.742 . . . . 0.0 107.919 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 p -115.34 -178.47 3.38 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.567 1.147 . . . . 0.0 113.112 -169.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -65.54 -13.54 59.15 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.2 m -139.1 -21.34 0.95 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -170.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -156.65 -172.71 4.17 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.844 1.258 . . . . 0.0 111.495 -178.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p90 -147.64 149.21 32.07 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.3 -0.875 . . . . 0.0 110.28 169.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 67.1 mtt-85 -146.86 145.63 29.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.289 1.435 . . . . 0.0 111.9 -171.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 14.3 mm -73.57 146.65 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.0 mtp -135.86 146.23 47.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.355 1.062 . . . . 0.0 111.483 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.9 m -140.14 165.49 30.21 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.703 1.601 . . . . 0.0 112.358 -169.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -59.79 -31.56 94.17 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.272 2.648 . . . . 0.0 114.642 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 45.33 -83.53 0.01 OUTLIER Glycine 0 CA--C 1.536 1.393 0 C-N-CA 127.719 2.58 . . . . 0.0 116.082 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -62.33 -39.56 93.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.955 1.302 . . . . 0.0 113.196 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.1 t -161.32 136.7 5.7 Favored Pre-proline 0 N--CA 1.478 0.93 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.45 -12.35 3.86 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.75 2.966 . . . . 0.0 112.995 169.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 m -70.21 -16.19 63.03 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -169.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -149.75 165.18 33.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.736 2.014 . . . . 0.0 109.556 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.6 t-105 -49.95 115.64 1.48 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.748 1.219 . . . . 0.0 112.002 178.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -150.55 149.89 30.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.263 1.425 . . . . 0.0 110.404 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -142.18 137.9 31.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.727 0.811 . . . . 0.0 112.72 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.3 t -141.91 135.23 14.3 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 126.964 2.106 . . . . 0.0 108.224 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.86 137.61 45.69 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.868 2.378 . . . . 0.0 111.644 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.1 tp -96.47 127.16 42.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.284 0.634 . . . . 0.0 111.375 -172.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -159.96 -24.25 0.07 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 169.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.22 -18.2 46.84 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -172.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -126.78 16.61 7.45 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.634 1.574 . . . . 0.0 113.097 174.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -129.46 4.08 5.11 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.237 1.815 . . . . 0.0 113.225 176.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.55 -65.19 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 130.389 3.475 . . . . 0.0 116.552 -177.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -152.99 4.89 0.35 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.298 1.839 . . . . 0.0 113.106 -176.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.81 36.37 0.21 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.016 1.726 . . . . 0.0 113.38 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.8 t -140.35 -157.1 0.74 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.049 2.54 . . . . 0.0 108.839 -173.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 43.78 43.81 5.24 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 171.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 56.78 21.81 6.35 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -176.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.09 -16.35 51.66 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 118.931 -2.356 . . . . 0.0 113.918 172.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.5 m0 -66.05 -18.82 65.59 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -170.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -140.44 170.7 15.31 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -172.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.77 15.7 2.32 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.485 1.514 . . . . 0.0 113.392 175.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -146.27 -0.91 0.75 Allowed 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 115.274 1.583 . . . . 0.0 115.274 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 13' ' ' ALA . 27.9 mt -120.58 162.63 19.31 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -168.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.6 t -139.13 131.24 28.03 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 128.442 2.697 . . . . 0.0 106.359 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -106.97 147.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 123.644 0.778 . . . . 0.0 111.183 -169.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -133.38 156.69 47.21 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.513 1.925 . . . . 0.0 109.549 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.12 162.88 31.7 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.06 0.944 . . . . 0.0 111.909 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.52 142.09 11.03 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.897 1.679 . . . . 0.0 110.002 169.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -72.59 -7.76 16.29 Favored 'Cis proline' 0 CA--C 1.546 1.083 0 CA-C-N 120.737 1.299 . . . . 0.0 113.32 -9.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -65.18 175.29 1.68 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.229 1.412 . . . . 0.0 112.073 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.58 142.28 19.0 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.254 1.022 . . . . 0.0 113.027 -174.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.33 91.71 1.11 Allowed 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 124.1 3.2 . . . . 0.0 110.826 177.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -157.38 138.45 13.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 0.0 110.272 -170.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -60.89 86.76 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.408 1.083 . . . . 0.0 112.006 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.7 m -95.69 -2.16 48.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.782 1.633 . . . . 0.0 113.161 -169.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.43 18.39 3.45 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 126.877 2.071 . . . . 0.0 114.449 -177.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -158.43 162.43 26.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 126.876 2.07 . . . . 0.0 109.348 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.28 152.4 75.82 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 CA-C-N 120.178 1.099 . . . . 0.0 110.441 169.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -102.85 -44.58 5.23 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.479 0.312 . . . . 0.0 110.289 170.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.0 t -74.85 132.8 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.864 0.866 . . . . 0.0 109.183 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.2 t -134.37 144.81 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.814 0.846 . . . . 0.0 110.796 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.4 mp -130.45 122.31 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 127.749 2.42 . . . . 0.0 109.46 -169.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.2 mt -87.92 159.75 18.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.997 0.904 . . . . 0.0 111.623 174.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.05 -27.57 63.71 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.127 1.371 . . . . 0.0 114.509 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -84.74 -5.18 59.31 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.088 1.355 . . . . 0.0 113.431 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.39 12.14 61.7 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.217 0.913 . . . . 0.0 114.61 -176.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -76.89 136.38 38.84 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 118.482 1.141 . . . . 0.0 108.734 169.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -130.01 148.32 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.054 1.341 . . . . 0.0 109.431 -172.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 p -51.49 124.06 24.01 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.047 0.939 . . . . 0.0 111.908 169.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -74.03 92.69 0.89 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.151 2.567 . . . . 0.0 111.6 177.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -134.34 -178.09 4.89 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.258 1.823 . . . . 0.0 112.093 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 m -141.68 147.63 37.79 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.665 0.786 . . . . 0.0 111.259 169.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.5 133.01 52.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.993 2.117 . . . . 0.0 108.438 -176.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -122.14 147.19 46.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.119 -176.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 52.3 mtt -123.85 129.5 51.11 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.983 1.313 . . . . 0.0 109.761 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.9 143.6 51.23 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.896 1.678 . . . . 0.0 111.061 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -53.49 124.18 14.15 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.525 1.13 . . . . 0.0 111.566 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.54 -20.6 56.75 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -112.07 -48.62 0.65 Allowed Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.773 1.177 . . . . 0.0 113.214 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.8 m -71.87 -22.02 61.58 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.13 0.965 . . . . 0.0 112.288 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 68.14 35.86 84.26 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.235 0.921 . . . . 0.0 113.49 177.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -133.06 132.72 22.48 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.422 1.489 . . . . 0.0 110.887 -169.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -53.11 145.06 44.32 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 124.051 3.167 . . . . 0.0 115.0 177.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -34.08 4.09 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.736 1.215 . . . . 0.0 111.44 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -154.4 157.58 38.74 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 111.997 -168.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 7.4 m -143.94 147.8 34.46 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.301 1.84 . . . . 0.0 109.403 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.6 mp -119.42 142.17 48.45 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 126.161 1.785 . . . . 0.0 108.784 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 40.0 t -135.11 134.4 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.665 0.786 . . . . 0.0 111.702 -169.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -108.86 161.29 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.958 1.303 . . . . 0.0 112.137 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.5 p -133.78 2.07 3.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.885 1.674 . . . . 0.0 113.766 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 121.56 -8.82 10.1 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.121 1.343 . . . . 0.0 114.503 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.4 p -155.65 159.38 39.54 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 118.59 1.195 . . . . 0.0 113.75 -174.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.8 t-105 -60.9 138.73 93.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.852 2.061 . . . . 0.0 115.732 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.6 175.55 10.3 Favored 'Cis proline' 0 CA--C 1.546 1.11 0 CA-C-N 119.926 1.009 . . . . 0.0 110.717 -11.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.0 154.31 42.11 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 122.203 1.001 . . . . 0.0 110.718 169.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -79.05 168.11 20.12 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.311 1.445 . . . . 0.0 109.047 169.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -144.42 130.63 19.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.546 1.538 . . . . 0.0 109.968 -177.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.3 t -151.83 160.83 43.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.956 1.302 . . . . 0.0 112.173 -171.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.33 131.09 35.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.412 -0.805 . . . . 0.0 109.142 169.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.27 61.08 0.55 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.203 1.801 . . . . 0.0 115.541 173.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 57.29 12.37 1.37 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.997 2.519 . . . . 0.0 117.291 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -55.63 -35.05 65.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.575 2.065 . . . . 0.0 116.575 -169.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -80.59 -15.64 56.13 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -66.65 133.93 94.23 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.075 0.95 . . . . 0.0 112.182 -169.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 C--O 1.249 1.062 0 C-N-CA 123.446 2.764 . . . . 0.0 113.17 178.334 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 . . . . . 0 CA--C 1.544 0.741 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -72.82 -38.36 67.18 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.985 -1.072 . . . . 0.0 113.033 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.83 -38.9 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.94 170.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.73 -44.03 97.27 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.317 0.962 . . . . 0.0 112.422 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -57.75 -46.33 84.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.085 1.311 . . . . 0.0 111.843 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.8 m -61.41 -57.11 13.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.615 0.766 . . . . 0.0 111.255 178.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -63.11 -34.39 77.51 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.145 1.378 . . . . 0.0 113.076 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.65 -52.76 63.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.692 1.587 . . . . 0.0 111.719 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -64.22 -41.87 96.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.93 -54.25 44.49 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.307 1.443 . . . . 0.0 112.417 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.3 m -60.6 -36.43 78.55 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.892 1.277 . . . . 0.0 111.414 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.91 86.9 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.5 99.29 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.433 -0.792 . . . . 0.0 111.915 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -61.39 -46.32 90.67 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 111.858 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -62.73 -41.42 99.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.473 0.709 . . . . 0.0 112.107 173.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.1 m -59.38 -41.55 89.59 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.1 0.863 . . . . 0.0 111.322 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -40.65 96.05 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.77 -1.206 . . . . 0.0 113.399 172.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.68 -30.98 71.75 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 121.144 -0.972 . . . . 0.0 113.234 174.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.0 tp -72.1 -34.52 68.7 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.39 1.076 . . . . 0.0 111.84 172.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.18 -46.11 90.39 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.058 -1.026 . . . . 0.0 111.467 169.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.9 tp -53.98 -46.83 71.81 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.082 1.353 . . . . 0.0 111.982 170.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.45 -43.67 88.92 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 175.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.33 -46.62 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.805 0.842 . . . . 0.0 110.981 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -31.28 69.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.924 0.89 . . . . 0.0 112.931 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.9 mtt-85 -80.28 -37.98 31.73 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.24 1.016 . . . . 0.0 113.483 172.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.93 -34.47 78.18 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.524 1.056 . . . . 0.0 113.369 -175.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.1 t -70.29 -20.18 63.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.94 -31.25 9.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.199 1.4 . . . . 0.0 114.336 -174.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.7 m -82.13 -14.19 56.09 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.81 -3.94 81.51 Favored Glycine 0 CA--C 1.54 1.632 0 C-N-CA 124.22 0.914 . . . . 0.0 115.069 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -139.99 151.84 66.21 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 128.399 2.68 . . . . 0.0 106.765 170.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -45.63 166.65 0.06 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.358 3.372 . . . . 0.0 115.871 169.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -123.22 161.22 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 126.283 1.833 . . . . 0.0 108.235 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -165.28 -175.56 36.04 Favored Glycine 0 N--CA 1.469 0.889 0 CA-C-N 120.698 1.59 . . . . 0.0 115.964 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -127.41 122.54 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.783 1.233 . . . . 0.0 110.886 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -83.4 68.88 9.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.346 1.858 . . . . 0.0 111.322 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -59.65 119.95 8.56 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.466 -0.771 . . . . 0.0 110.219 169.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 84.1 p -141.33 13.52 2.18 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -169.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.76 -47.28 0.26 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.693 2.797 . . . . 0.0 115.169 -174.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.7 m -69.27 -26.95 65.01 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.63 1.172 . . . . 0.0 112.611 171.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.47 166.63 31.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.425 1.89 . . . . 0.0 111.043 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -155.96 99.39 1.97 Allowed 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.915 -0.491 . . . . 0.0 111.558 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -142.42 161.69 37.39 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -169.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.1 mm -71.47 142.52 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.528 1.131 . . . . 0.0 111.213 -171.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 81.0 mtp -128.4 146.67 50.72 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.796 1.638 . . . . 0.0 110.17 169.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 m -133.7 158.86 74.52 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 125.922 1.689 . . . . 0.0 111.26 -170.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -52.39 144.84 38.66 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.417 2.745 . . . . 0.0 115.503 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -101.62 -151.24 24.31 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 125.513 1.53 . . . . 0.0 113.087 175.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -55.42 -23.7 26.36 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.2 p -133.27 65.5 72.93 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 119.44 1.018 . . . . 0.0 113.204 -169.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -63.09 -17.19 58.93 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 123.04 2.493 . . . . 0.0 113.272 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -59.59 -15.36 18.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.427 1.491 . . . . 0.0 114.008 169.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.85 -87.39 0.2 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.62 1.168 . . . . 0.0 111.947 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -162.88 110.08 1.23 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.435 1.094 . . . . 0.0 111.874 -171.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.58 151.29 29.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.211 1.004 . . . . 0.0 110.11 169.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -138.69 150.5 46.26 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -171.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.8 t -143.4 138.96 15.96 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 126.957 2.103 . . . . 0.0 108.686 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.93 145.82 90.63 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.592 2.194 . . . . 0.0 111.304 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.42 45.46 0.23 Allowed 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -170.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -58.01 -20.76 41.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 119.635 -1.915 . . . . 0.0 113.841 172.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -59.42 -18.84 42.56 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.245 1.018 . . . . 0.0 113.686 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -130.69 -35.27 1.47 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.2 1.0 . . . . 0.0 113.498 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.13 -8.19 59.29 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 177.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.14 -60.29 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 129.436 3.095 . . . . 0.0 116.158 -173.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -148.03 -0.55 0.6 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.431 1.892 . . . . 0.0 112.898 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -92.23 0.49 57.46 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.674 -1.266 . . . . 0.0 113.415 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.2 p -64.57 13.89 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 128.456 2.702 . . . . 0.0 117.28 -172.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -154.44 42.82 0.51 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.557 1.543 . . . . 0.0 111.717 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -136.59 163.2 31.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.562 1.545 . . . . 0.0 112.878 -173.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -72.7 -177.42 2.3 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.782 0.833 . . . . 0.0 110.78 168.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -120.45 -6.83 9.77 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -150.64 -168.66 3.17 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -168.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -125.22 2.67 7.85 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.458 1.903 . . . . 0.0 114.382 -175.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -150.12 -4.33 0.36 Allowed 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -169.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.4 mt -105.84 167.91 9.47 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.707 -1.246 . . . . 0.0 113.139 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.7 t -140.76 136.59 32.68 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.427 2.291 . . . . 0.0 107.83 169.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.72 145.36 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.47 1.108 . . . . 0.0 111.272 -169.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -137.76 157.56 46.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.239 1.816 . . . . 0.0 110.142 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.508 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.8 tt -151.22 146.01 25.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.9 0.88 . . . . 0.0 112.089 -171.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.508 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.2 pm0 -151.69 150.88 27.44 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.579 1.552 . . . . 0.0 111.125 169.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -80.04 -13.12 35.62 Favored 'Cis proline' 0 CA--C 1.543 0.943 0 CA-C-N 120.198 1.107 . . . . 0.0 114.451 -0.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -64.19 144.23 57.29 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.948 0.88 . . . . 0.0 113.234 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -62.49 128.87 92.08 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.539 1.536 . . . . 0.0 112.008 170.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.59 57.58 6.15 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 123.768 2.979 . . . . 0.0 109.673 169.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.39 150.0 26.45 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.039 1.336 . . . . 0.0 113.369 -169.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -74.17 47.98 0.3 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.859 1.664 . . . . 0.0 112.579 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.1 m -67.96 -5.59 17.9 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.942 1.697 . . . . 0.0 115.383 -172.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 56.31 27.83 12.47 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 126.157 1.783 . . . . 0.0 113.516 -174.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -146.9 163.12 30.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 109.3 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.75 147.54 85.79 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 CA-C-N 120.085 1.066 . . . . 0.0 111.867 169.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -95.3 -50.47 5.01 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.686 1.194 . . . . 0.0 109.806 170.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 68.3 t -89.66 136.4 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.371 1.468 . . . . 0.0 108.15 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 48.8 t -135.16 143.57 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-O 122.147 0.975 . . . . 0.0 111.947 -171.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -117.19 111.03 33.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 128.582 2.753 . . . . 0.0 107.639 -176.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.15 153.07 36.48 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.134 0.973 . . . . 0.0 109.81 177.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.82 -21.93 44.94 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.28 -11.4 59.9 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.275 1.43 . . . . 0.0 113.573 176.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.48 42.67 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.499 1.047 . . . . 0.0 114.187 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.69 147.44 29.58 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.981 1.312 . . . . 0.0 108.103 173.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -121.97 150.88 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.693 0.797 . . . . 0.0 110.585 -168.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.3 p -56.78 130.52 78.18 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.693 169.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -74.97 134.08 17.42 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.34 2.027 . . . . 0.0 112.201 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.461 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 14.5 p90 -163.92 177.28 8.68 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.693 1.997 . . . . 0.0 111.346 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.4 p -138.54 148.49 44.31 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.015 0.912 . . . . 0.0 110.646 169.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 tp -135.81 130.19 33.6 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.835 2.054 . . . . 0.0 108.089 -169.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -121.2 150.25 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.007 1.323 . . . . 0.0 110.363 -173.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 55.3 mtt -127.53 139.66 52.63 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 125.561 1.545 . . . . 0.0 108.669 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -136.83 151.39 49.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.293 1.437 . . . . 0.0 111.11 -177.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -61.73 119.8 9.41 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.365 1.066 . . . . 0.0 109.685 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.1 -19.4 61.42 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -174.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -101.66 -45.02 1.86 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 124.073 0.844 . . . . 0.0 113.609 -177.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.6 p -80.29 -27.82 38.42 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.707 1.254 . . . . 0.0 112.858 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 79.75 0.86 85.99 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 125.119 1.342 . . . . 0.0 113.928 -172.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -75.9 138.42 69.45 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 118.564 1.182 . . . . 0.0 111.638 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.25 154.59 72.86 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.566 2.177 . . . . 0.0 111.798 175.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.25 -51.32 1.19 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.983 1.713 . . . . 0.0 112.06 -169.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.82 153.12 40.55 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 126.847 2.059 . . . . 0.0 108.426 -169.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 4.9 m -143.97 136.84 27.28 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.539 0.736 . . . . 0.0 109.506 172.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.1 mp -116.55 143.78 45.18 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.819 2.448 . . . . 0.0 108.096 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 24.0 t -141.44 134.1 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.901 0.48 . . . . 0.0 111.911 -171.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.461 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.7 t -112.72 114.64 27.31 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.943 1.697 . . . . 0.0 110.305 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.4 p -75.34 -13.2 60.4 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.935 1.294 . . . . 0.0 114.296 174.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 128.21 0.62 6.36 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.414 1.483 . . . . 0.0 114.339 -175.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 19.5 m -156.56 156.06 32.97 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.428 -1.631 . . . . 0.0 112.996 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 30.3 t-105 -60.09 140.15 90.87 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 125.939 1.696 . . . . 0.0 115.344 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -94.29 176.55 12.33 Favored 'Cis proline' 0 CA--C 1.546 1.089 0 CA-C-N 119.932 1.011 . . . . 0.0 110.751 -11.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.1 mp -67.87 149.52 49.73 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.069 -1.019 . . . . 0.0 110.746 169.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -77.87 170.7 16.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.982 1.313 . . . . 0.0 110.282 170.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -140.01 144.45 36.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.781 1.632 . . . . 0.0 111.394 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.7 t -153.42 151.55 30.02 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.889 1.275 . . . . 0.0 111.7 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.88 134.22 50.48 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.588 -0.695 . . . . 0.0 109.841 170.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.68 67.87 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 127.423 2.289 . . . . 0.0 116.579 171.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.3 mtm105 55.7 19.65 3.51 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.27 -17.52 12.24 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -177.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 8.3 t -134.09 28.34 3.8 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.022 1.329 . . . . 0.0 113.334 169.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.66 71.23 71.03 Favored Pre-proline 0 N--CA 1.481 1.12 0 C-N-CA 125.282 1.433 . . . . 0.0 110.677 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo . . . . . 0 C--O 1.251 1.167 1 C-N-CA 125.507 4.138 . . . . 0.0 116.048 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.58 -40.13 80.66 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.107 0.867 . . . . 0.0 112.316 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.46 -46.4 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.253 0.621 . . . . 0.0 109.957 174.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.22 87.38 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.731 0.696 . . . . 0.0 112.37 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -63.63 -46.42 85.76 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.204 0.911 . . . . 0.0 112.219 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.6 m -56.72 -49.77 74.19 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.932 175.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -67.47 -28.57 67.97 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.001 -1.0 . . . . 0.0 113.615 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.52 -48.09 78.99 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 120.711 1.596 . . . . 0.0 111.37 171.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -67.74 -40.64 84.14 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.829 1.252 . . . . 0.0 111.431 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.75 -38.65 80.28 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.697 0.799 . . . . 0.0 113.038 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.5 m -69.71 -34.44 73.9 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 120.117 -1.614 . . . . 0.0 111.853 175.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.65 91.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 170.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.29 92.94 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 112.06 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -64.49 -45.08 88.84 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.016 0.926 . . . . 0.0 112.328 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -62.76 -40.35 97.0 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.195 0.598 . . . . 0.0 112.342 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -60.86 -44.08 97.49 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.796 0.726 . . . . 0.0 110.795 175.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.75 98.29 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.686 -1.259 . . . . 0.0 113.391 172.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.49 76.15 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.14 -0.975 . . . . 0.0 113.097 175.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.1 tp -73.13 -31.74 64.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.439 1.095 . . . . 0.0 111.818 173.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -62.97 -44.31 96.39 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.935 -1.103 . . . . 0.0 110.864 169.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.15 -44.64 67.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.376 1.47 . . . . 0.0 111.321 169.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.28 97.15 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.2 mt -64.14 -45.0 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.202 1.001 . . . . 0.0 111.099 174.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.43 -43.52 75.44 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.803 0.841 . . . . 0.0 112.1 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.73 -31.77 61.92 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 178.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.8 89.7 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.414 1.007 . . . . 0.0 113.191 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -76.08 -24.26 55.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.12 -31.11 13.7 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -174.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.2 p -89.5 -14.52 35.07 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -169.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.23 6.53 78.27 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 170.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.62 151.71 54.51 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.987 2.115 . . . . 0.0 107.596 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -46.88 149.31 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 121.98 1.787 . . . . 0.0 111.652 167.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.19 164.93 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.323 1.849 . . . . 0.0 108.486 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.29 -178.68 30.68 Favored Glycine 0 C--N 1.332 0.308 0 O-C-N 120.762 -1.211 . . . . 0.0 115.404 -174.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.6 mt -135.6 120.88 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.564 1.146 . . . . 0.0 108.543 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -89.97 141.89 28.23 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 126.156 1.783 . . . . 0.0 110.861 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -140.07 130.23 25.06 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.137 1.775 . . . . 0.0 109.449 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 t -132.55 179.66 6.0 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.233 1.413 . . . . 0.0 111.039 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -61.85 -14.95 38.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -169.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 -8.42 0.92 Allowed 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 -178.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.5 164.52 36.08 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.778 1.172 . . . . 0.0 113.248 -177.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -149.67 156.22 41.52 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.269 1.828 . . . . 0.0 112.006 -175.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -161.26 148.0 14.73 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.727 1.611 . . . . 0.0 111.342 -175.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.9 mm -68.23 147.68 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 124.411 1.085 . . . . 0.0 109.566 172.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 44.7 mtp -135.75 150.67 49.58 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.474 -1.391 . . . . 0.0 112.466 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 9.4 m -144.06 168.03 13.67 Favored Pre-proline 0 N--CA 1.478 0.969 0 C-N-CA 126.219 1.808 . . . . 0.0 111.736 -169.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -57.53 -33.74 96.95 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.821 2.347 . . . . 0.0 114.089 171.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.46 -50.27 0.61 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 127.47 2.462 . . . . 0.0 116.673 170.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -137.72 -26.52 0.96 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.342 1.457 . . . . 0.0 114.578 -170.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.0 t -148.84 74.94 10.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 123.8 0.84 . . . . 0.0 112.646 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -63.35 -11.5 25.92 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.996 2.464 . . . . 0.0 113.624 170.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.2 m -60.08 -16.89 35.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.538 1.935 . . . . 0.0 114.662 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.01 171.01 15.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.133 1.773 . . . . 0.0 110.472 175.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.3 t-105 -62.8 112.39 2.52 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.366 -0.834 . . . . 0.0 111.145 173.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.457 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 4.6 tpm_? -150.65 157.29 42.8 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.852 1.261 . . . . 0.0 110.98 174.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.457 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 85.4 m95 -139.19 138.46 36.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.207 1.403 . . . . 0.0 111.945 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.77 138.86 17.57 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 126.966 2.106 . . . . 0.0 107.795 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.08 128.74 22.49 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.84 2.36 . . . . 0.0 111.183 175.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.3 tp -76.17 78.8 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.366 1.066 . . . . 0.0 111.133 -176.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -91.3 5.46 49.12 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.32 1.048 . . . . 0.0 112.24 171.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -50.11 110.54 0.41 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.728 2.011 . . . . 0.0 111.966 173.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.0 t70 57.95 -29.71 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.533 2.733 . . . . 0.0 116.385 -171.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 72' ' ' SER . . . -68.38 -18.29 64.43 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.346 1.859 . . . . 0.0 113.644 175.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.73 -178.01 0.14 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.329 2.652 . . . . 0.0 115.653 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -72.8 23.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.967 1.707 . . . . 0.0 114.619 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.31 7.18 5.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.896 2.078 . . . . 0.0 111.216 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.401 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 73.3 p -79.83 -23.53 41.96 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.357 1.463 . . . . 0.0 114.084 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -74.08 123.19 23.93 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.248 1.019 . . . . 0.0 109.207 169.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -147.43 -179.48 6.88 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.098 0.959 . . . . 0.0 112.801 -169.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.91 25.51 10.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.05 2.14 . . . . 0.0 112.579 -177.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER 58.17 -44.66 0.05 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 130.131 3.372 . . . . 0.0 118.413 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -156.55 -167.91 2.54 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.334 0.97 . . . . 0.0 113.409 -169.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -128.09 -14.14 4.97 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.785 2.034 . . . . 0.0 113.121 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -120.42 5.03 10.69 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.59 1.556 . . . . 0.0 111.904 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -139.26 141.63 37.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.531 1.532 . . . . 0.0 110.064 -169.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 88.9 p -137.14 154.91 50.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.678 1.991 . . . . 0.0 111.39 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.07 147.6 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.107 1.363 . . . . 0.0 112.173 -169.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -139.68 162.28 35.49 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.898 2.079 . . . . 0.0 110.838 170.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.2 mt -141.14 155.95 46.02 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.592 1.157 . . . . 0.0 113.932 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.69 155.14 22.18 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.893 2.077 . . . . 0.0 110.325 169.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.13 -9.16 18.38 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 CA-C-N 120.469 1.203 . . . . 0.0 113.207 -9.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.16 172.01 1.59 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.613 1.565 . . . . 0.0 113.361 173.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -126.31 121.66 23.81 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.368 1.867 . . . . 0.0 110.932 -170.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.5 98.3 0.94 Allowed 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.698 2.265 . . . . 0.0 110.475 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -154.35 157.23 38.27 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.483 1.513 . . . . 0.0 111.301 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -70.52 47.0 0.09 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 128.219 2.608 . . . . 0.0 114.358 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.6 t -65.05 160.96 19.8 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.101 2.16 . . . . 0.0 114.303 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -63.81 -13.79 47.4 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.628 1.571 . . . . 0.0 112.727 169.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -131.04 162.78 53.52 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.271 1.428 . . . . 0.0 112.571 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -70.81 164.56 35.13 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.179 2.586 . . . . 0.0 112.416 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -95.57 -21.94 17.94 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.619 1.568 . . . . 0.0 112.398 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.1 t -114.11 143.26 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.547 1.139 . . . . 0.0 108.875 169.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.2 t -136.18 137.75 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 110.326 -178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -125.25 117.97 51.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 128.679 2.791 . . . . 0.0 106.925 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.15 148.58 35.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.385 0.612 . . . . 0.0 110.224 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.9 -22.79 60.16 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -70.02 -22.82 63.07 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.08 1.752 . . . . 0.0 113.458 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 104.09 5.13 44.17 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.98 1.276 . . . . 0.0 115.056 -179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.554 ' C ' HD12 ' A' ' 105' ' ' ILE . 9.1 pt20 -90.55 154.53 19.54 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.81 1.644 . . . . 0.0 109.869 169.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.554 HD12 ' C ' ' A' ' 104' ' ' GLN . 1.2 mp -129.76 142.7 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 124.696 1.198 . . . . 0.0 109.605 -169.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t -56.17 140.43 70.98 Favored Pre-proline 0 N--CA 1.477 0.875 0 C-N-CA 123.541 0.736 . . . . 0.0 112.642 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -64.73 131.18 28.45 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.765 2.31 . . . . 0.0 112.601 169.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.435 ' CZ ' HD21 ' A' ' 132' ' ' LEU . 26.1 p90 -161.52 173.57 14.63 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.785 1.634 . . . . 0.0 111.364 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.3 t -134.28 135.55 42.94 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.07 0.948 . . . . 0.0 110.194 169.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.1 tp -128.64 116.0 18.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 128.06 2.544 . . . . 0.0 108.467 -169.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -105.35 147.06 28.58 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.752 1.221 . . . . 0.0 110.444 -173.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 51.1 mtt -128.38 130.56 47.86 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.849 1.66 . . . . 0.0 109.753 -176.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -134.26 152.29 51.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.773 1.229 . . . . 0.0 112.29 -169.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -64.93 110.4 2.43 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.116 1.367 . . . . 0.0 110.528 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.56 -15.83 59.12 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.69 -20.49 59.75 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.721 1.153 . . . . 0.0 114.384 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -132.03 -21.28 2.4 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.987 1.393 . . . . 0.0 114.424 -171.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 86.78 -1.09 86.88 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 125.599 1.571 . . . . 0.0 114.4 -176.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -83.97 131.51 51.2 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.583 1.191 . . . . 0.0 112.517 -171.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 143.47 40.48 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.531 2.821 . . . . 0.0 113.568 169.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.11 -44.66 1.15 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.686 1.594 . . . . 0.0 112.151 -172.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 tt -149.94 155.21 39.58 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.833 1.653 . . . . 0.0 108.172 -178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 85.5 m -144.04 151.11 39.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.233 -1.542 . . . . 0.0 109.505 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 78.1 mt -128.11 133.59 49.03 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 127.295 2.238 . . . . 0.0 108.323 -169.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.5 t -133.58 135.92 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 122.982 0.513 . . . . 0.0 111.995 -169.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 34.0 t -119.41 141.0 49.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.945 1.698 . . . . 0.0 110.443 175.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -127.94 2.28 5.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.193 1.397 . . . . 0.0 113.833 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 152.59 -20.14 0.8 Allowed Glycine 0 CA--C 1.535 1.317 0 N-CA-C 115.852 1.101 . . . . 0.0 115.852 175.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 4.9 t -156.26 165.27 36.87 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.771 1.785 . . . . 0.0 114.345 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 -63.86 143.66 98.1 Favored Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 127.738 2.415 . . . . 0.0 115.333 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -91.44 177.26 15.84 Favored 'Cis proline' 0 CA--C 1.546 1.102 0 CA-C-N 119.479 0.85 . . . . 0.0 110.472 -11.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.435 HD21 ' CZ ' ' A' ' 108' ' ' PHE . 6.6 mp -68.3 156.26 38.07 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.061 -1.024 . . . . 0.0 111.66 169.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -101.98 129.02 48.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.445 1.498 . . . . 0.0 110.858 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -84.58 149.62 25.76 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.844 1.258 . . . . 0.0 112.048 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.0 t -149.77 146.17 27.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.028 1.731 . . . . 0.0 109.623 169.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.28 136.49 42.64 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.097 -1.002 . . . . 0.0 109.814 170.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 61.07 0.11 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.365 2.266 . . . . 0.0 115.427 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 11.6 ptm180 44.7 27.95 0.3 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.128 2.571 . . . . 0.0 117.763 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.76 -34.57 65.33 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.14 -4.1 58.56 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 174.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.37 48.67 0.51 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.25 1.42 . . . . 0.0 114.612 -170.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo . . . . . 0 C--O 1.249 1.058 0 C-N-CA 123.501 2.8 . . . . 0.0 113.173 179.555 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 . . . . . 0 CA--C 1.546 0.809 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -76.92 -3.72 40.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.035 1.334 . . . . 0.0 114.425 175.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.3 t -129.54 -35.67 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 126.021 1.729 . . . . 0.0 111.696 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.64 73.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.719 1.208 . . . . 0.0 113.563 -173.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -60.01 -52.31 65.92 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.591 1.087 . . . . 0.0 111.919 174.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.9 m -60.08 -44.45 94.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.985 0.914 . . . . 0.0 111.386 177.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -33.92 76.11 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.268 1.027 . . . . 0.0 112.866 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.07 -48.78 78.7 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.872 1.215 . . . . 0.0 111.302 170.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -62.47 -38.34 89.47 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.523 1.129 . . . . 0.0 111.913 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.22 -50.34 68.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.09 1.356 . . . . 0.0 111.932 170.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.8 m -62.52 -32.94 73.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.549 1.14 . . . . 0.0 111.389 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.8 80.22 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.596 1.158 . . . . 0.0 113.292 170.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.3 95.29 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.462 -0.774 . . . . 0.0 111.736 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.99 -47.37 86.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.111 1.364 . . . . 0.0 112.058 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.59 -42.2 98.52 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.698 0.799 . . . . 0.0 112.458 171.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 59.6 m -59.29 -40.79 87.26 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.558 -0.714 . . . . 0.0 111.283 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.99 92.52 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.808 -1.183 . . . . 0.0 113.374 172.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.19 -33.73 76.45 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.202 -0.936 . . . . 0.0 112.915 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -70.37 -35.26 73.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.554 1.142 . . . . 0.0 112.147 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.62 -44.32 96.58 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.076 -1.015 . . . . 0.0 111.723 170.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.2 tp -54.11 -46.48 72.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.148 1.379 . . . . 0.0 111.534 170.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.02 96.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.3 mt -62.51 -46.53 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.261 0.937 . . . . 0.0 110.806 173.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.38 -36.59 78.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.463 0.705 . . . . 0.0 112.599 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -73.69 -30.67 63.02 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.04 0.936 . . . . 0.0 113.14 174.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.05 -39.77 90.41 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.971 1.259 . . . . 0.0 114.083 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -68.23 -29.04 67.77 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.675 -0.641 . . . . 0.0 112.121 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.1 mt -79.87 -33.77 39.75 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.025 1.33 . . . . 0.0 113.055 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.8 m -75.39 -22.57 57.36 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -173.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.89 9.79 71.37 Favored Glycine 0 CA--C 1.541 1.706 0 C-N-CA 123.74 0.686 . . . . 0.0 114.434 -176.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -151.15 150.64 27.79 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 128.402 2.681 . . . . 0.0 107.592 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -47.66 149.95 4.5 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.508 2.139 . . . . 0.0 112.741 168.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -116.17 165.31 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 126.913 2.085 . . . . 0.0 108.714 -175.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -150.59 175.42 29.62 Favored Glycine 0 CA--C 1.52 0.371 0 O-C-N 121.024 -1.047 . . . . 0.0 115.508 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.6 mt -132.67 120.1 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 124.858 1.263 . . . . 0.0 108.316 178.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -81.86 146.03 30.06 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.306 1.442 . . . . 0.0 110.771 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -142.35 138.3 31.13 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.461 1.905 . . . . 0.0 110.587 174.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.8 p -129.6 -177.61 4.34 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.661 1.584 . . . . 0.0 112.09 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.09 -15.6 14.87 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.1 p -142.61 -11.06 0.81 Allowed 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.466 2.025 . . . . 0.0 116.466 -172.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -150.73 172.13 16.06 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.117 1.326 . . . . 0.0 113.816 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -141.72 158.61 43.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.136 1.774 . . . . 0.0 110.849 171.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -158.51 161.92 37.41 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 124.064 0.945 . . . . 0.0 112.916 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.7 mm -80.08 145.05 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.563 1.145 . . . . 0.0 108.849 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 70.2 mtp -135.81 143.38 45.14 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.209 1.003 . . . . 0.0 111.636 175.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.45 166.25 20.92 Favored Pre-proline 0 N--CA 1.483 1.192 0 C-N-CA 126.223 1.809 . . . . 0.0 111.177 -169.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.63 163.4 24.49 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.725 2.284 . . . . 0.0 113.285 171.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.41 -84.37 0.09 OUTLIER Glycine 0 N--CA 1.472 1.059 0 C-N-CA 123.86 0.743 . . . . 0.0 114.292 176.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 10.8 mmpt? -61.41 -31.31 71.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.712 0.805 . . . . 0.0 113.013 -176.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.7 t -158.0 140.67 10.6 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 124.456 1.103 . . . . 0.0 111.37 169.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -81.93 5.17 6.49 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 124.055 3.17 . . . . 0.0 112.52 169.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.2 m -62.56 -27.9 69.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -171.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -159.58 -49.74 0.05 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -148.23 -74.93 0.18 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -169.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -8.64 83.02 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 129.261 3.024 . . . . 0.0 116.454 -169.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -66.3 161.02 23.27 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.486 1.514 . . . . 0.0 114.693 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 41.4 t -140.36 142.34 29.16 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 128.262 2.625 . . . . 0.0 107.626 174.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.6 43.15 0.63 Allowed 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.854 3.702 . . . . 0.0 113.172 173.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.6 tp 52.92 -90.01 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.395 2.678 . . . . 0.0 112.665 -169.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 51.31 12.96 0.16 Allowed 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -66.61 -23.39 66.17 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.64 -1.287 . . . . 0.0 113.394 173.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -141.02 -38.96 0.41 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.753 1.621 . . . . 0.0 111.411 172.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 40.06 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.337 1.855 . . . . 0.0 112.579 169.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.88 -25.04 0.26 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 128.982 2.913 . . . . 0.0 118.787 -168.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -140.48 18.5 2.38 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.923 1.289 . . . . 0.0 111.76 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -146.03 18.38 1.42 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.756 1.223 . . . . 0.0 114.256 -169.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.4 p -68.28 -35.48 77.92 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.911 -1.118 . . . . 0.0 112.539 171.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -68.92 119.45 13.27 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.177 1.391 . . . . 0.0 111.229 170.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -138.14 179.94 6.15 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.009 1.724 . . . . 0.0 111.249 -170.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -136.91 178.74 6.84 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.817 2.047 . . . . 0.0 110.127 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -144.03 -46.79 0.27 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.42 163.24 21.29 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -169.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -143.03 -17.67 0.66 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.115 1.366 . . . . 0.0 114.445 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -132.06 14.87 4.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.649 1.58 . . . . 0.0 112.317 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.5 mt -118.87 162.42 18.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.538 1.135 . . . . 0.0 113.613 -175.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.8 t -138.23 133.87 33.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 128.008 2.523 . . . . 0.0 107.385 169.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.21 144.05 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 111.081 -169.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -137.79 149.78 46.67 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.99 1.716 . . . . 0.0 110.226 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.6 mt -126.72 151.82 47.65 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.419 1.088 . . . . 0.0 112.069 -172.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -143.61 128.0 9.45 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.654 1.582 . . . . 0.0 110.016 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -79.1 -3.99 37.06 Favored 'Cis proline' 0 CA--C 1.547 1.169 0 CA-C-N 120.544 1.23 . . . . 0.0 113.36 -9.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -62.26 157.39 19.67 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -169.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -89.2 124.11 65.54 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 126.849 2.06 . . . . 0.0 109.968 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.23 81.59 2.42 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.465 2.777 . . . . 0.0 110.962 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -152.66 149.17 28.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.958 1.303 . . . . 0.0 112.529 -171.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -80.73 54.63 2.17 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.111 -0.993 . . . . 0.0 112.574 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 m -70.89 31.36 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.749 2.42 . . . . 0.0 115.305 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 58.68 15.97 4.06 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.017 2.127 . . . . 0.0 114.575 -172.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -149.22 162.38 29.11 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 125.539 1.536 . . . . 0.0 111.634 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.23 159.59 40.37 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.552 2.168 . . . . 0.0 110.668 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -85.54 -54.49 4.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.793 0.837 . . . . 0.0 109.895 171.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.6 t -83.03 137.73 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.598 1.159 . . . . 0.0 109.254 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 78.8 t -130.5 142.6 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-O 121.621 0.724 . . . . 0.0 110.754 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -128.66 123.66 59.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 128.147 2.579 . . . . 0.0 109.343 -169.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.9 mt -80.77 159.52 25.15 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 111.452 170.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.11 -24.54 67.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.422 1.089 . . . . 0.0 113.636 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.16 -10.04 59.31 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.856 1.663 . . . . 0.0 113.502 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.04 4.56 59.98 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.603 1.097 . . . . 0.0 114.988 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -72.36 141.56 48.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.637 1.218 . . . . 0.0 109.042 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -130.73 153.36 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.938 1.295 . . . . 0.0 109.966 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.8 p -49.5 120.48 10.61 Favored Pre-proline 0 N--CA 1.473 0.686 0 C-N-CA 124.767 1.227 . . . . 0.0 111.76 169.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.9 76.67 3.66 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.824 3.016 . . . . 0.0 111.901 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -115.88 -178.53 3.42 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.994 1.718 . . . . 0.0 112.797 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.2 m -138.8 150.85 46.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.141 0.972 . . . . 0.0 112.231 169.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.62 137.92 40.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 127.063 2.145 . . . . 0.0 108.389 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.6 tt -127.88 147.16 50.45 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.18 1.392 . . . . 0.0 110.475 -174.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.8 mtt -125.2 130.4 52.05 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 125.047 1.339 . . . . 0.0 109.46 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.08 146.7 50.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.921 1.689 . . . . 0.0 111.426 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -46.85 121.55 3.68 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.802 1.241 . . . . 0.0 111.145 171.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.04 -31.37 51.21 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -170.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.07 -21.24 7.84 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.614 0.626 . . . . 0.0 114.183 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.8 m -108.11 -21.71 12.68 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.902 0.881 . . . . 0.0 112.664 -169.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.29 -3.31 78.16 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.663 1.125 . . . . 0.0 114.951 173.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -69.47 122.11 84.51 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 125.599 1.56 . . . . 0.0 111.281 175.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -55.35 141.95 80.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.027 2.484 . . . . 0.0 113.082 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.07 -39.05 5.4 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.955 0.902 . . . . 0.0 110.267 169.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -149.97 154.69 38.67 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.08 1.352 . . . . 0.0 110.763 -169.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 6.6 m -139.42 145.0 38.35 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.898 1.679 . . . . 0.0 108.339 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.4 mt -123.24 134.79 54.08 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 127.408 2.283 . . . . 0.0 107.632 -175.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 7.7 t -136.02 138.82 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.488 0.715 . . . . 0.0 111.619 -168.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.0 t -114.82 124.98 53.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.221 1.008 . . . . 0.0 111.626 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 74.6 p -74.39 -16.83 60.88 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.171 1.389 . . . . 0.0 114.262 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.78 -1.1 12.13 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 125.504 1.526 . . . . 0.0 113.741 -169.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.6 t -154.93 158.77 39.78 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.093 -1.239 . . . . 0.0 113.054 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -59.92 137.21 90.61 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.127 1.771 . . . . 0.0 114.83 -178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -96.59 176.78 9.35 Favored 'Cis proline' 0 CA--C 1.548 1.191 0 CA-C-N 120.04 1.05 . . . . 0.0 111.026 -11.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.56 163.66 20.72 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.127 -0.983 . . . . 0.0 111.069 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -117.62 134.21 55.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.626 1.57 . . . . 0.0 111.23 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -89.49 146.08 24.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 111.855 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 t -150.36 147.99 28.26 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.151 1.38 . . . . 0.0 111.018 169.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.1 mp -74.76 128.81 36.46 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.557 -0.714 . . . . 0.0 109.116 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.02 63.42 0.26 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.281 1.832 . . . . 0.0 115.841 175.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.05 2.29 1.02 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.895 2.478 . . . . 0.0 116.74 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -54.11 -27.15 31.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -169.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.99 5.49 12.86 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.568 1.547 . . . . 0.0 112.582 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -71.51 -47.72 12.76 Favored Pre-proline 0 N--CA 1.476 0.835 0 CA-C-O 116.568 -1.682 . . . . 0.0 114.761 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 C--O 1.25 1.124 0 C-N-CA 122.546 2.164 . . . . 0.0 113.11 -179.158 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.99 -40.64 87.43 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.66 -45.88 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.225 0.61 . . . . 0.0 109.774 173.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.3 -46.55 88.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.545 0.738 . . . . 0.0 112.565 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -58.39 -51.49 69.58 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.615 0.766 . . . . 0.0 112.331 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.9 m -57.86 -47.6 82.26 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.362 0.665 . . . . 0.0 111.319 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -70.5 -29.27 65.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.854 1.261 . . . . 0.0 113.912 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.7 -49.28 71.5 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 120.576 1.535 . . . . 0.0 110.461 171.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -62.48 -40.54 97.01 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.768 1.227 . . . . 0.0 111.936 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -63.23 -47.83 80.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.598 1.159 . . . . 0.0 112.298 172.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.2 m -57.7 -40.66 80.03 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.067 0.947 . . . . 0.0 111.204 175.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.36 78.41 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.09 -44.63 96.25 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.566 -0.709 . . . . 0.0 111.665 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -68.28 -39.33 82.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.632 0.773 . . . . 0.0 112.42 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.04 -45.24 91.25 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.69 0.677 . . . . 0.0 111.83 169.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -60.81 -42.99 98.73 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.858 0.754 . . . . 0.0 110.73 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.94 -40.18 94.65 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.957 -1.089 . . . . 0.0 113.538 172.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.96 -31.13 71.86 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.27 1.028 . . . . 0.0 113.092 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.7 tp -73.33 -35.72 66.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.279 1.432 . . . . 0.0 111.427 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -62.11 -45.2 94.54 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.082 -1.011 . . . . 0.0 110.88 169.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 tp -51.9 -46.35 64.55 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.441 1.496 . . . . 0.0 111.075 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.82 97.73 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.26 -44.2 99.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.687 0.795 . . . . 0.0 110.598 175.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.56 -49.88 76.07 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.265 0.626 . . . . 0.0 111.562 174.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.0 mmt85 -59.28 -34.81 72.72 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.036 -1.04 . . . . 0.0 112.414 175.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.52 66.96 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.132 0.878 . . . . 0.0 111.765 178.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -25.04 63.11 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.633 -0.667 . . . . 0.0 112.523 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.7 mt -81.93 -43.08 18.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.682 1.193 . . . . 0.0 112.381 175.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.5 p -84.24 -17.5 39.58 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -173.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.87 11.68 83.48 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 175.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.89 172.56 6.18 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.185 1.394 . . . . 0.0 110.147 171.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.13 159.64 14.76 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.455 2.103 . . . . 0.0 114.907 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.6 t -130.52 156.49 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 127.249 2.219 . . . . 0.0 107.53 171.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.99 169.78 35.3 Favored Glycine 0 N--CA 1.468 0.814 0 CA-C-N 120.323 1.42 . . . . 0.0 116.256 -171.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.43 128.85 66.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 125.178 1.391 . . . . 0.0 108.829 -173.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -107.64 59.95 0.62 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 129.178 2.991 . . . . 0.0 110.635 -168.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -53.84 141.13 28.19 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.3 1.04 . . . . 0.0 112.056 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.5 t -139.42 179.52 6.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.067 1.747 . . . . 0.0 111.769 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -66.64 -16.93 64.55 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -169.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.0 p -142.81 -5.02 0.92 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.76 -175.36 5.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.065 1.746 . . . . 0.0 110.599 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -146.07 164.82 30.92 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.697 1.599 . . . . 0.0 109.851 173.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.6 ttp-105 -148.45 154.97 40.6 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.104 1.762 . . . . 0.0 109.814 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.3 mt -114.82 141.18 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.576 1.151 . . . . 0.0 109.272 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 85.3 mtp -132.6 148.33 52.36 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 -174.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.8 158.28 37.43 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.777 2.431 . . . . 0.0 108.86 -168.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.51 153.09 79.01 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 122.104 1.869 . . . . 0.0 112.034 169.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.3 4.72 0.98 Allowed Glycine 0 CA--C 1.537 1.406 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -137.59 -23.71 1.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.6 t -158.21 139.09 9.39 Favored Pre-proline 0 N--CA 1.477 0.911 0 CA-C-N 119.44 1.018 . . . . 0.0 112.829 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.63 -12.78 3.56 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.299 3.333 . . . . 0.0 112.187 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.7 t -82.96 -22.38 33.77 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.056 1.342 . . . . 0.0 113.479 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.78 162.06 37.69 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.349 1.46 . . . . 0.0 111.721 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -52.4 123.34 10.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.472 1.509 . . . . 0.0 112.429 177.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -153.23 160.18 42.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.518 1.527 . . . . 0.0 111.86 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -145.28 146.24 31.57 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.693 1.197 . . . . 0.0 113.6 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.1 t -158.01 153.65 22.66 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.993 2.917 . . . . 0.0 107.724 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -69.52 134.64 28.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.236 1.958 . . . . 0.0 111.064 173.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.456 ' O ' HD23 ' A' ' 64' ' ' LEU . 2.4 tt -68.68 -26.28 65.22 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 123.328 1.537 . . . . 0.0 109.787 173.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -49.52 -14.31 0.11 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 127.968 2.507 . . . . 0.0 113.746 169.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -53.54 -32.74 51.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.929 1.692 . . . . 0.0 112.753 168.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -135.27 -13.04 2.1 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -176.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -121.58 58.24 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.209 1.403 . . . . 0.0 109.074 169.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.63 -23.43 1.01 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 -169.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -121.16 -4.2 9.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -171.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -129.08 -7.0 4.89 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.9 m -75.55 14.37 0.63 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.251 1.02 . . . . 0.0 113.603 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -155.63 -179.2 7.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.42 1.488 . . . . 0.0 110.988 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -51.93 128.02 22.93 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -168.86 -27.86 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.086 2.154 . . . . 0.0 111.439 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -69.23 -6.25 27.96 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.545 1.938 . . . . 0.0 114.796 -170.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.88 165.44 24.63 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.895 1.678 . . . . 0.0 113.442 -178.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.56 13.22 2.13 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.32 1.448 . . . . 0.0 112.841 171.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -155.09 3.48 0.2 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -168.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -120.19 162.87 18.62 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.292 -1.505 . . . . 0.0 113.482 -169.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 t -135.98 143.3 44.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.043 2.137 . . . . 0.0 108.735 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.9 143.88 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.116 1.366 . . . . 0.0 110.641 -169.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -140.17 134.51 31.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.352 1.461 . . . . 0.0 110.601 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mp -113.41 153.03 29.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.235 1.017 . . . . 0.0 113.15 -174.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -145.45 140.34 15.81 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 126.875 2.07 . . . . 0.0 108.745 -172.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -80.1 -5.95 41.37 Favored 'Cis proline' 0 CA--C 1.546 1.077 0 CA-C-N 120.841 1.336 . . . . 0.0 114.015 -3.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -107.35 155.96 19.43 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.84 1.256 . . . . 0.0 113.305 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.82 135.49 95.46 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -84.16 98.23 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 123.633 2.889 . . . . 0.0 108.797 168.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -148.0 156.38 42.59 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.028 -1.045 . . . . 0.0 112.259 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 41.75 0.28 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.99 1.716 . . . . 0.0 112.093 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 55.5 p -73.2 39.18 0.09 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.622 1.969 . . . . 0.0 115.281 -171.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.6 t30 57.33 19.5 5.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 127.022 2.129 . . . . 0.0 115.015 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -158.04 124.33 2.49 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.626 1.17 . . . . 0.0 110.429 -169.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.89 128.94 30.92 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 121.712 1.608 . . . . 0.0 111.212 172.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -78.34 -39.24 40.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.953 0.901 . . . . 0.0 111.311 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -99.98 136.23 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.896 1.678 . . . . 0.0 108.174 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.5 t -135.54 143.82 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 121.868 0.842 . . . . 0.0 111.108 -172.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -125.49 129.56 72.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 128.384 2.674 . . . . 0.0 107.968 -171.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.4 mt -94.08 162.62 13.8 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.097 0.951 . . . . 0.0 112.061 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.74 -9.41 6.36 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -175.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -121.12 9.74 10.57 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.746 1.619 . . . . 0.0 113.298 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.74 8.69 59.22 Favored Glycine 0 CA--C 1.535 1.304 0 N-CA-C 115.833 1.093 . . . . 0.0 115.833 173.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -74.93 137.8 41.92 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.9 1.35 . . . . 0.0 108.551 169.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.37 146.11 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.909 1.284 . . . . 0.0 109.479 -173.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.2 p -52.24 124.37 30.77 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 124.022 0.929 . . . . 0.0 111.539 170.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.64 112.87 3.59 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.742 2.295 . . . . 0.0 111.096 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.563 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.5 p90 -151.45 -179.27 7.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.35 1.86 . . . . 0.0 111.661 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -138.19 142.48 40.03 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.622 0.769 . . . . 0.0 112.156 169.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.07 102.77 8.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 129.235 3.014 . . . . 0.0 108.833 -170.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -96.62 147.9 23.4 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.544 1.138 . . . . 0.0 110.563 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.4 mtt -129.85 135.48 48.44 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.879 1.672 . . . . 0.0 109.271 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.66 152.71 48.3 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.158 1.383 . . . . 0.0 111.0 -176.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -61.09 127.28 30.78 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 121.814 -0.554 . . . . 0.0 109.806 175.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.97 -20.34 57.11 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -175.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.85 -32.65 0.68 Allowed Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.301 0.953 . . . . 0.0 114.582 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 6.9 m -68.38 -27.47 66.26 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.257 1.528 . . . . 0.0 111.255 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 70.55 35.82 68.06 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.806 0.717 . . . . 0.0 113.195 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -133.34 135.61 25.7 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 125.668 1.587 . . . . 0.0 110.439 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.41 152.33 79.0 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.012 2.475 . . . . 0.0 113.071 -176.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.34 -55.21 1.76 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.214 1.805 . . . . 0.0 111.565 -173.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -147.98 156.47 42.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 108.643 -169.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.6 m -147.46 138.56 23.65 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.059 -1.026 . . . . 0.0 110.243 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -109.61 146.21 35.13 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 126.814 2.046 . . . . 0.0 109.729 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 54.0 t -140.38 137.17 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.098 0.959 . . . . 0.0 112.038 -169.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.563 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 38.4 t -115.27 154.26 29.41 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.906 1.682 . . . . 0.0 111.641 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.4 m -130.35 9.52 5.18 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.944 1.298 . . . . 0.0 113.488 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.87 -9.61 10.45 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 114.943 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.9 p -156.53 160.07 39.15 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.637 1.219 . . . . 0.0 113.517 -173.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.0 t-105 -60.23 138.5 91.65 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.297 1.839 . . . . 0.0 115.501 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -97.9 177.22 7.93 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.128 1.081 . . . . 0.0 110.935 -11.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.26 160.26 32.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.855 169.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -100.81 166.04 11.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.065 1.346 . . . . 0.0 109.046 169.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -142.07 153.12 43.94 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.2 t -155.86 167.09 31.53 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.233 1.413 . . . . 0.0 112.254 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.89 135.85 48.25 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 109.971 169.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.98 70.5 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.724 2.41 . . . . 0.0 116.547 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 46.4 ptt85 44.03 31.6 0.54 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 128.798 2.839 . . . . 0.0 118.398 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -55.37 -24.04 27.58 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 174.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.6 p -97.43 -0.89 45.43 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.822 2.049 . . . . 0.0 113.759 176.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -138.54 62.18 28.17 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 126.33 1.852 . . . . 0.0 110.743 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.268 3.312 . . . . 0.0 113.369 178.968 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.8 -13.51 34.29 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.865 1.266 . . . . 0.0 114.084 172.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -131.71 -44.2 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.681 1.992 . . . . 0.0 111.181 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.56 79.58 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.448 1.499 . . . . 0.0 113.331 -177.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -65.55 -44.79 85.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.158 0.89 . . . . 0.0 111.207 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.3 m -62.01 -45.82 91.94 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.282 -0.886 . . . . 0.0 111.593 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -60.04 -38.55 83.1 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.328 -0.844 . . . . 0.0 112.253 175.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.81 -47.27 87.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.493 1.042 . . . . 0.0 112.032 174.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -63.54 -41.4 98.45 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.217 1.007 . . . . 0.0 111.379 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.98 -53.32 51.97 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 122.694 0.398 . . . . 0.0 111.782 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.0 m -55.76 -37.12 68.1 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.964 1.306 . . . . 0.0 111.425 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.14 -47.74 83.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.38 1.072 . . . . 0.0 113.89 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.81 98.13 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.389 -0.819 . . . . 0.0 112.254 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -65.08 -42.59 93.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.485 0.714 . . . . 0.0 110.959 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -60.08 -43.71 95.3 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.199 0.6 . . . . 0.0 112.408 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 34.9 m -59.82 -41.79 92.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 118.597 0.635 . . . . 0.0 111.156 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.39 -40.88 94.02 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.864 -1.148 . . . . 0.0 113.5 172.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.75 -33.51 75.82 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.171 -0.956 . . . . 0.0 113.041 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.49 -35.85 75.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.448 1.099 . . . . 0.0 111.742 173.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.36 -44.22 95.44 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.91 -1.119 . . . . 0.0 111.773 170.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.57 -45.15 62.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.188 1.395 . . . . 0.0 111.471 169.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.09 98.11 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.64 -45.79 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 118.898 0.772 . . . . 0.0 110.713 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.87 -23.95 66.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -103.03 -24.78 13.61 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.33 74.59 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.983 1.265 . . . . 0.0 113.801 176.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.7 t -69.4 -28.28 66.02 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 121.637 -0.664 . . . . 0.0 112.73 173.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.4 mt -85.2 -28.59 25.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.518 1.527 . . . . 0.0 113.219 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -86.44 -15.73 39.34 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -169.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.1 -9.3 33.3 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 124.507 1.051 . . . . 0.0 115.266 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -138.32 150.84 68.03 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 129.447 3.099 . . . . 0.0 105.406 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -40.41 154.97 0.05 OUTLIER 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.099 3.199 . . . . 0.0 115.507 169.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.9 t -104.01 161.84 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.871 1.268 . . . . 0.0 108.311 171.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -154.44 176.28 32.3 Favored Glycine 0 CA--C 1.522 0.521 0 CA-C-O 122.299 0.944 . . . . 0.0 114.991 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 63.2 mt -134.95 118.42 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 124.504 1.122 . . . . 0.0 108.002 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -76.8 152.97 35.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.347 1.459 . . . . 0.0 110.687 170.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -143.02 147.85 35.79 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.391 1.477 . . . . 0.0 113.03 -175.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.7 p -136.58 -176.36 4.32 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.569 1.948 . . . . 0.0 111.302 176.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.63 -25.29 62.55 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 178.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.6 p -143.2 -2.09 1.02 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -173.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.73 179.87 7.15 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.86 1.314 . . . . 0.0 112.988 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.482 ' CZ2' ' HA ' ' A' ' 74' ' ' ASN . 58.6 p-90 -149.15 162.78 39.3 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.303 2.241 . . . . 0.0 108.762 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 41.8 mtm-85 -143.96 132.04 21.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.402 1.081 . . . . 0.0 111.208 172.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.3 mm -69.76 130.82 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 171.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.8 mtm -134.11 147.79 50.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 122.077 0.942 . . . . 0.0 111.719 -176.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.7 164.83 33.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.912 1.285 . . . . 0.0 111.786 -169.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.03 -23.41 75.68 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.755 2.97 . . . . 0.0 114.527 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.86 -53.53 1.69 Allowed Glycine 0 CA--C 1.533 1.201 0 C-N-CA 126.929 2.204 . . . . 0.0 116.556 169.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -142.62 -23.05 0.66 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.294 1.437 . . . . 0.0 114.299 -172.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.3 t -133.32 124.12 18.06 Favored Pre-proline 0 N--CA 1.475 0.805 0 CA-C-N 119.021 0.828 . . . . 0.0 113.021 -174.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -86.55 -0.02 8.04 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.82 3.013 . . . . 0.0 111.929 169.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.7 m -111.74 -5.22 14.46 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.662 1.585 . . . . 0.0 114.262 -169.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -141.79 146.04 35.46 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.064 1.346 . . . . 0.0 110.839 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -51.27 -37.26 46.33 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.95 1.7 . . . . 0.0 115.047 -171.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 9.2 tpt85 -27.32 96.97 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 129.007 2.923 . . . . 0.0 115.241 -171.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.22 154.82 34.97 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.305 1.042 . . . . 0.0 112.124 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.6 m -143.82 151.0 51.97 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 125.886 1.674 . . . . 0.0 110.164 169.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.14 145.87 80.02 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.183 1.922 . . . . 0.0 110.21 169.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 63.6 tp -57.12 -71.84 0.09 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.337 1.055 . . . . 0.0 113.595 -169.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 43.83 1.79 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 130.612 3.565 . . . . 0.0 120.45 169.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -60.42 -21.76 62.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.499 1.919 . . . . 0.0 115.351 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -150.35 -38.94 0.14 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.951 1.701 . . . . 0.0 110.698 170.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.78 44.35 0.08 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.112 2.165 . . . . 0.0 113.12 169.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.31 20.44 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 -169.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -133.36 25.96 4.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.084 1.354 . . . . 0.0 112.033 170.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -120.19 -6.89 9.89 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.848 1.659 . . . . 0.0 111.679 173.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.9 m -71.16 -2.12 14.75 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.804 1.642 . . . . 0.0 113.123 169.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -139.5 168.99 18.58 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.571 1.548 . . . . 0.0 113.253 -175.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.482 ' HA ' ' CZ2' ' A' ' 47' ' ' TRP . 59.0 t30 -51.13 119.55 4.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 117.307 2.336 . . . . 0.0 117.307 -169.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -141.72 10.19 2.01 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.54 2.336 . . . . 0.0 111.459 169.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -79.52 -17.23 54.5 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.03 1.332 . . . . 0.0 113.529 -176.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.11 167.3 28.15 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -144.08 27.71 1.43 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.802 2.041 . . . . 0.0 110.247 169.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -141.45 -5.81 1.06 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.442 1.497 . . . . 0.0 114.636 -169.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.2 mt -115.3 163.4 15.74 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.865 1.317 . . . . 0.0 113.614 -170.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.2 t -134.38 134.79 42.1 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 128.672 2.789 . . . . 0.0 106.797 169.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.51 144.26 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.421 1.088 . . . . 0.0 110.884 -169.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -137.36 157.4 46.67 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.028 1.731 . . . . 0.0 109.585 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -153.71 168.56 25.84 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.546 -0.721 . . . . 0.0 112.902 172.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -157.65 155.08 26.43 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.525 1.93 . . . . 0.0 110.269 177.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -77.46 -10.75 31.7 Favored 'Cis proline' 0 CA--C 1.543 0.946 0 CA-C-N 120.898 1.357 . . . . 0.0 114.864 2.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -66.1 -178.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.303 1.441 . . . . 0.0 111.586 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.73 141.11 29.63 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -176.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.39 131.44 24.8 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.825 2.35 . . . . 0.0 110.407 175.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -160.38 -154.52 0.38 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.587 0.755 . . . . 0.0 111.523 -169.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -135.71 26.81 3.36 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.954 2.502 . . . . 0.0 110.148 169.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.2 m -60.37 156.87 14.9 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.124 2.17 . . . . 0.0 115.086 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -71.96 20.05 0.06 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 126.031 1.732 . . . . 0.0 114.84 175.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -150.36 161.29 31.11 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.379 1.872 . . . . 0.0 109.823 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.99 172.07 16.24 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 122.902 2.402 . . . . 0.0 112.964 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -108.64 -10.58 15.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.87 1.668 . . . . 0.0 111.958 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.56 139.33 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.238 1.415 . . . . 0.0 108.811 169.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.443 ' H ' HG22 ' A' ' 106' ' ' THR . 58.8 t -134.31 139.3 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 109.577 -175.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.92 119.16 48.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 126.635 1.974 . . . . 0.0 109.5 -169.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.64 152.27 40.55 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.373 1.469 . . . . 0.0 111.187 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.01 -28.64 58.15 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.895 1.278 . . . . 0.0 114.127 172.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.94 -11.31 59.59 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.628 1.571 . . . . 0.0 113.58 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.25 4.77 59.62 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 124.648 1.118 . . . . 0.0 114.887 -177.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -72.24 150.99 43.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.491 1.145 . . . . 0.0 108.408 169.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -128.82 137.55 56.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 124.774 1.23 . . . . 0.0 108.427 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.443 HG22 ' H ' ' A' ' 98' ' ' VAL . 6.3 t -56.26 133.34 75.61 Favored Pre-proline 0 CA--C 1.544 0.75 0 CA-C-O 118.522 -0.752 . . . . 0.0 111.255 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -59.94 117.53 4.29 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.562 2.175 . . . . 0.0 112.82 174.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 5.6 p90 -155.13 175.6 13.63 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.448 1.499 . . . . 0.0 111.356 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 p -142.14 153.2 43.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.499 1.12 . . . . 0.0 110.508 169.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.12 134.67 33.18 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.884 2.073 . . . . 0.0 109.142 -169.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -125.71 143.17 51.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.461 1.504 . . . . 0.0 110.383 -175.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.4 mtt -122.07 128.98 51.98 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.556 1.542 . . . . 0.0 109.667 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.11 146.16 50.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.64 1.576 . . . . 0.0 111.573 -175.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -54.18 124.98 17.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.48 1.112 . . . . 0.0 109.927 171.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.55 -14.07 17.76 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 -174.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -103.9 -50.05 1.04 Allowed Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.917 1.246 . . . . 0.0 113.417 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.4 p -79.45 -27.77 41.62 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.442 1.121 . . . . 0.0 113.558 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.97 8.27 73.05 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.987 0.803 . . . . 0.0 113.01 -169.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.38 134.66 58.22 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 124.901 1.28 . . . . 0.0 110.836 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.57 144.13 65.38 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.787 2.325 . . . . 0.0 112.663 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.24 -40.38 4.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.922 0.889 . . . . 0.0 110.125 169.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.45 154.81 38.36 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.327 1.051 . . . . 0.0 111.383 -169.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.9 m -145.75 145.78 30.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.966 1.307 . . . . 0.0 109.986 177.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.5 mp -120.17 144.55 47.63 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.122 2.569 . . . . 0.0 109.365 -179.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 15.9 t -142.23 138.07 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.253 1.021 . . . . 0.0 111.581 -170.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 10.6 t -116.7 152.89 33.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.432 1.093 . . . . 0.0 112.234 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 39.6 m -130.5 5.86 4.77 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.312 1.445 . . . . 0.0 113.19 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.85 -15.25 5.43 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 115.915 1.126 . . . . 0.0 115.915 172.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.2 t -151.64 159.04 44.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.76 1.78 . . . . 0.0 113.798 -172.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 -57.5 135.28 82.02 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 126.465 1.906 . . . . 0.0 115.524 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -96.28 175.98 10.34 Favored 'Cis proline' 0 CA--C 1.547 1.146 0 CA-C-N 120.139 1.086 . . . . 0.0 110.603 -11.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.43 161.75 22.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.245 1.022 . . . . 0.0 112.085 169.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -90.12 154.79 19.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.208 1.403 . . . . 0.0 107.788 169.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -139.44 152.54 47.12 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.3 t -155.18 151.35 28.09 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.692 1.197 . . . . 0.0 112.031 -169.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.98 131.92 45.85 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 169.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.57 66.08 0.12 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.628 1.971 . . . . 0.0 115.267 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 52.05 13.77 0.29 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 118.58 2.808 . . . . 0.0 118.58 178.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -57.51 -32.17 66.76 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -169.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 68.3 p -79.77 -18.21 51.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 68.4 ttt-85 -66.73 -47.03 56.54 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-O 116.54 -1.695 . . . . 0.0 115.263 -171.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo . . . . . 0 C--O 1.249 1.071 0 C-N-CA 122.729 2.286 . . . . 0.0 113.223 -178.428 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 . . . . . 0 N--CA 1.473 0.684 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -66.57 -42.07 87.62 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.24 -40.05 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.716 -0.659 . . . . 0.0 109.987 175.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.3 95.95 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.311 0.959 . . . . 0.0 112.659 173.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.19 -42.43 96.65 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.049 -1.032 . . . . 0.0 111.575 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.0 m -61.16 -50.37 73.42 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.745 0.818 . . . . 0.0 111.711 173.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -57.46 -40.4 78.44 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.914 1.686 . . . . 0.0 112.408 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.98 72.01 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.989 0.813 . . . . 0.0 111.376 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -61.73 -41.69 97.99 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.129 0.972 . . . . 0.0 111.876 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.47 -50.01 71.38 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.767 1.227 . . . . 0.0 112.538 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 61.8 m -65.28 -30.26 71.11 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.237 -0.915 . . . . 0.0 112.113 174.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.9 87.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.679 1.127 . . . . 0.0 113.496 172.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.85 -43.76 98.2 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.35 -0.844 . . . . 0.0 111.372 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -64.76 -39.2 93.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.525 0.73 . . . . 0.0 112.664 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -61.31 -42.5 98.77 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 111.774 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.8 m -59.32 -43.86 92.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.424 0.556 . . . . 0.0 110.727 175.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -41.87 96.5 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.981 -1.075 . . . . 0.0 113.474 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.86 -32.71 74.32 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.997 0.919 . . . . 0.0 113.128 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.9 tp -73.04 -33.87 65.96 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.06 1.344 . . . . 0.0 111.683 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.41 -44.23 95.26 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.948 -1.095 . . . . 0.0 110.877 169.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.7 -45.33 66.82 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.34 1.456 . . . . 0.0 111.288 169.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.61 98.03 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.92 -47.29 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.088 0.858 . . . . 0.0 110.684 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -60.34 -35.44 75.65 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.708 0.803 . . . . 0.0 112.796 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -76.29 -36.63 58.26 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.389 0.676 . . . . 0.0 112.626 174.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.92 -36.06 82.72 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.833 1.197 . . . . 0.0 112.96 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -73.32 -27.32 61.46 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.9 -25.34 23.3 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.9 m -89.28 -22.07 22.88 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -169.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.75 5.85 89.27 Favored Glycine 0 CA--C 1.542 1.734 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -143.44 150.81 52.67 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 127.653 2.381 . . . . 0.0 107.302 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -46.24 163.25 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.761 2.974 . . . . 0.0 114.593 169.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -123.37 160.72 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.616 1.566 . . . . 0.0 108.459 176.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.63 173.75 34.37 Favored Glycine 0 CA--C 1.521 0.458 0 N-CA-C 116.111 1.204 . . . . 0.0 116.111 -177.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.2 mt -132.63 123.66 49.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.832 1.253 . . . . 0.0 108.998 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -83.48 145.76 28.76 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.597 1.959 . . . . 0.0 110.758 170.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -141.55 145.2 34.82 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.311 1.445 . . . . 0.0 111.801 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.2 p -146.83 176.12 10.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.996 1.318 . . . . 0.0 112.056 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -61.09 -10.11 5.66 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.445 1.098 . . . . 0.0 113.86 170.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.9 m -130.7 -15.8 3.44 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.92 168.73 24.82 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 123.178 1.466 . . . . 0.0 114.079 -178.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -135.74 144.33 45.8 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.904 2.882 . . . . 0.0 105.478 169.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -160.01 129.62 5.26 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.674 0.79 . . . . 0.0 111.508 -172.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mt -92.57 139.36 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.2 mtp -136.66 145.27 44.59 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.038 0.935 . . . . 0.0 112.189 -169.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 m -138.46 160.79 62.22 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 126.574 1.95 . . . . 0.0 112.137 -169.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -81.17 12.04 2.82 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.048 3.165 . . . . 0.0 115.406 -171.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -39.66 -40.17 1.44 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 127.005 2.24 . . . . 0.0 118.687 -169.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -69.1 -44.5 72.35 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.219 1.51 . . . . 0.0 112.895 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -167.92 129.87 1.24 Allowed Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 123.935 0.894 . . . . 0.0 112.83 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.2 -24.6 6.55 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.029 2.486 . . . . 0.0 111.725 169.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.4 m -75.18 -24.86 57.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.542 1.537 . . . . 0.0 113.517 -175.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.48 21.06 4.73 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.339 1.455 . . . . 0.0 112.674 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . 0.27 0.0 OUTLIER 54.08 -13.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 131.567 3.947 . . . . 0.0 120.288 173.475 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -38.74 110.01 0.12 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 128.062 2.545 . . . . 0.0 114.198 -170.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.87 153.92 40.64 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.172 1.389 . . . . 0.0 113.92 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 t -136.49 140.59 32.84 Favored Pre-proline 0 N--CA 1.469 0.495 0 C-N-CA 126.891 2.076 . . . . 0.0 108.194 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -63.53 151.71 83.69 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 CA-C-N 121.156 1.449 . . . . 0.0 109.716 169.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 15.8 tp -65.65 12.7 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -176.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -61.38 -13.53 20.64 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.022 -1.674 . . . . 0.0 114.077 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.58 -15.09 24.3 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.358 1.063 . . . . 0.0 113.424 169.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -141.58 -44.59 0.36 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.091 1.356 . . . . 0.0 112.389 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.56 47.69 1.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.212 1.805 . . . . 0.0 111.697 173.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.7 -35.15 1.71 Allowed 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 -169.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -129.08 15.25 6.26 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.212 1.405 . . . . 0.0 112.578 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -143.46 6.05 1.45 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -174.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 82.6 p -58.18 -20.13 38.69 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -157.95 168.89 25.87 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.49 1.516 . . . . 0.0 113.48 -169.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.81 -41.1 0.07 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.84 3.256 . . . . 0.0 118.008 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -73.19 70.42 1.12 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.309 1.844 . . . . 0.0 111.331 176.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -129.15 -28.71 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -168.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.58 176.65 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.413 1.006 . . . . 0.0 113.642 -176.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -125.93 -25.04 3.67 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.579 1.952 . . . . 0.0 113.477 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -139.17 14.53 2.62 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.383 1.073 . . . . 0.0 113.599 -169.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -124.16 156.19 37.14 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -168.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.3 m -133.01 134.3 44.25 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.565 2.746 . . . . 0.0 107.806 169.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -113.37 141.51 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.366 1.066 . . . . 0.0 110.55 -169.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -140.1 85.56 2.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.554 1.542 . . . . 0.0 110.426 -170.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.3 157.22 37.43 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.928 -1.107 . . . . 0.0 112.486 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.82 145.34 27.45 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.852 1.661 . . . . 0.0 109.365 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.56 -14.29 24.46 Favored 'Cis proline' 0 CA--C 1.543 0.975 0 CA-C-N 120.076 1.063 . . . . 0.0 113.825 -4.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -60.62 119.95 9.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.142 1.377 . . . . 0.0 112.328 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.43 145.83 85.89 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.262 1.025 . . . . 0.0 113.505 -177.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.92 63.96 8.73 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 124.311 3.341 . . . . 0.0 112.386 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -147.67 159.13 44.12 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.158 1.383 . . . . 0.0 111.735 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -74.34 89.63 2.1 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.655 1.217 . . . . 0.0 113.594 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 p -61.02 -3.41 0.79 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 128.043 2.537 . . . . 0.0 116.224 171.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 2.6 p30 54.31 6.9 0.12 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.476 2.31 . . . . 0.0 115.82 -169.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -140.84 165.37 30.04 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 128.66 2.784 . . . . 0.0 108.23 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.2 155.09 65.26 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-N 120.094 1.069 . . . . 0.0 112.155 169.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -102.37 -44.55 5.36 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.595 1.158 . . . . 0.0 110.72 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.79 135.72 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.47 ' H ' HG22 ' A' ' 106' ' ' THR . 89.7 t -136.04 139.12 46.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.684 1.194 . . . . 0.0 109.745 -177.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.5 119.43 50.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 127.578 2.351 . . . . 0.0 108.206 -170.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -83.23 159.55 21.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.768 0.794 . . . . 0.0 111.355 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.25 -26.12 50.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.074 1.349 . . . . 0.0 114.449 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -76.01 -16.67 59.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.805 1.642 . . . . 0.0 113.595 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.05 7.14 64.41 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.331 0.967 . . . . 0.0 114.498 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -84.66 143.23 29.35 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 169.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.4 mm -125.75 149.77 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.14 1.376 . . . . 0.0 109.966 -168.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.47 HG22 ' H ' ' A' ' 98' ' ' VAL . 11.8 t -56.34 134.07 76.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 O-C-N 121.655 -0.653 . . . . 0.0 110.925 169.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -75.65 117.35 4.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.51 2.14 . . . . 0.0 111.216 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.518 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 10.1 p90 -149.05 179.09 8.14 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 127.055 2.142 . . . . 0.0 111.021 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -138.59 155.54 48.25 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 111.246 169.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.4 tp -136.97 103.72 5.24 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.875 2.07 . . . . 0.0 108.985 -169.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -95.19 147.09 23.83 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.364 0.665 . . . . 0.0 110.446 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 59.0 mtt -126.7 125.66 42.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.741 1.616 . . . . 0.0 110.392 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.79 140.1 52.25 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.205 1.402 . . . . 0.0 111.55 -176.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -64.52 119.38 10.34 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.142 0.977 . . . . 0.0 110.565 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.43 -22.03 52.93 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 178.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -84.38 -19.57 60.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.724 1.154 . . . . 0.0 115.269 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.2 p -135.18 -24.56 1.42 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.276 1.538 . . . . 0.0 114.445 -170.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 84.6 -1.78 88.56 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.975 1.274 . . . . 0.0 114.105 -172.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -79.45 138.97 55.18 Favored Pre-proline 0 CA--C 1.545 0.773 0 CA-C-N 118.682 1.241 . . . . 0.0 112.22 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.14 146.42 57.81 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.779 2.319 . . . . 0.0 111.642 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.94 -42.06 2.85 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.976 0.91 . . . . 0.0 111.265 174.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -148.86 159.73 43.9 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.589 1.156 . . . . 0.0 111.245 -168.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.8 m -148.2 139.99 23.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.728 1.211 . . . . 0.0 109.521 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.9 mp -109.55 144.82 37.32 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.524 1.93 . . . . 0.0 109.374 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 35.1 t -138.48 136.14 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.654 1.182 . . . . 0.0 111.366 -169.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.518 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 20.1 t -115.98 154.87 29.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.108 1.363 . . . . 0.0 111.843 178.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 m -131.98 9.95 4.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.187 1.395 . . . . 0.0 113.267 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 115.89 -6.75 19.81 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.85 1.214 . . . . 0.0 115.217 176.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 73.4 m -149.05 150.66 33.15 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.649 1.224 . . . . 0.0 113.33 -169.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -58.45 137.0 85.66 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 124.909 1.284 . . . . 0.0 114.41 173.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.17 174.66 11.54 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 CA-C-N 120.147 1.088 . . . . 0.0 111.032 -11.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.28 166.01 15.13 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.076 0.941 . . . . 0.0 110.937 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -110.54 165.05 12.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.999 1.32 . . . . 0.0 109.132 171.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -141.98 155.66 45.45 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.4 t -151.87 151.08 30.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.678 1.591 . . . . 0.0 111.005 -173.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.73 133.04 47.82 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 67.91 0.07 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.871 2.068 . . . . 0.0 115.431 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 0.0 OUTLIER 50.05 16.47 0.24 Allowed 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.28 -34.32 70.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.5 p -88.26 -12.31 44.02 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 174.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -61.8 134.91 94.2 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.011 0.925 . . . . 0.0 112.523 -169.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo . . . . . 0 C--O 1.25 1.088 0 C-N-CA 123.691 2.927 . . . . 0.0 113.264 168.878 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.914 0.388 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.46 -11.59 16.94 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.801 2.04 . . . . 0.0 115.156 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.07 -44.44 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 125.652 1.581 . . . . 0.0 110.088 173.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.23 -38.42 86.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -56.23 -50.02 72.48 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.275 0.943 . . . . 0.0 112.65 172.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.6 m -64.77 -49.59 70.16 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.564 0.746 . . . . 0.0 111.131 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -72.16 -26.82 62.24 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -172.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.06 -53.32 58.62 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.44 1.018 . . . . 0.0 110.767 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -66.47 -36.56 83.07 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.286 0.634 . . . . 0.0 112.502 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -59.69 -48.6 81.02 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.17 169.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.3 m -58.93 -41.51 87.52 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.538 0.735 . . . . 0.0 111.179 176.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.62 -40.4 88.76 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 175.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.7 96.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.339 -0.851 . . . . 0.0 111.533 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.34 -44.56 96.2 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.829 0.852 . . . . 0.0 111.704 174.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -59.81 -44.34 94.06 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 172.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 48.3 m -61.16 -44.04 97.94 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.819 0.736 . . . . 0.0 110.8 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.76 95.36 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.053 -1.029 . . . . 0.0 113.165 172.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.18 -33.94 77.2 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.016 0.926 . . . . 0.0 113.143 175.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -71.7 -33.16 68.55 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.654 1.182 . . . . 0.0 112.143 171.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -63.93 -43.74 94.96 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.888 -1.132 . . . . 0.0 111.14 169.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.33 -45.54 69.11 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.77 1.628 . . . . 0.0 111.255 169.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.32 -47.04 86.01 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.478 0.711 . . . . 0.0 112.394 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -59.11 -41.23 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.787 -1.196 . . . . 0.0 111.401 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.04 -42.32 97.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.439 0.696 . . . . 0.0 112.768 172.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -63.44 -35.08 79.24 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.603 1.161 . . . . 0.0 112.943 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.0 95.07 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -174.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.3 t -76.85 -23.08 52.71 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 98.6 mt -89.61 -36.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.64 1.176 . . . . 0.0 113.172 -176.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.0 p -84.34 -16.58 42.41 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.47 -0.01 76.95 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -142.59 149.25 49.92 Favored Pre-proline 0 N--CA 1.471 0.582 0 C-N-CA 126.438 1.895 . . . . 0.0 108.576 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -47.66 144.81 10.25 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.214 1.942 . . . . 0.0 111.077 168.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.5 m -109.39 175.12 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.773 0.829 . . . . 0.0 111.15 -178.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.38 165.69 30.95 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 115.408 0.923 . . . . 0.0 115.408 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.47 116.07 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 124.915 1.286 . . . . 0.0 107.955 177.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 34.5 t-80 -80.52 147.14 30.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 126.775 2.03 . . . . 0.0 111.243 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.9 142.18 30.65 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.706 1.602 . . . . 0.0 111.622 -179.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 24.1 p -132.94 177.0 7.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.782 1.633 . . . . 0.0 111.553 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -57.99 -14.72 7.0 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 170.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.9 m -137.06 -10.72 1.74 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -169.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.34 174.4 15.49 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.932 1.242 . . . . 0.0 112.602 179.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 12.4 p90 -142.07 156.06 45.39 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.409 1.484 . . . . 0.0 110.018 169.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -150.91 151.93 32.89 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.167 1.387 . . . . 0.0 110.64 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 6.0 mt -109.15 141.84 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.977 0.808 . . . . 0.0 109.606 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.1 mtp -134.74 149.98 50.51 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.421 1.088 . . . . 0.0 111.407 -175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.4 m -142.48 169.19 11.38 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 127.073 2.149 . . . . 0.0 111.372 -169.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -55.94 -36.37 95.65 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.476 2.784 . . . . 0.0 114.862 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 66.14 -42.38 0.16 Allowed Glycine 0 CA--C 1.541 1.659 0 C-N-CA 127.147 2.308 . . . . 0.0 117.037 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -143.84 -31.25 0.47 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -172.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.4 p -134.0 57.06 22.06 Favored Pre-proline 0 N--CA 1.485 1.289 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -169.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.24 -20.51 70.29 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 122.871 2.381 . . . . 0.0 114.547 -177.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -64.11 -8.94 13.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.322 1.449 . . . . 0.0 114.453 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -135.98 -128.53 0.15 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.262 1.825 . . . . 0.0 110.595 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -139.53 118.42 12.48 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.685 1.594 . . . . 0.0 109.894 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -152.53 159.5 43.29 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.36 1.464 . . . . 0.0 110.654 176.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 40.8 m95 -136.4 130.32 32.55 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.695 1.198 . . . . 0.0 112.239 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.2 t -142.38 138.0 16.08 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 126.748 2.019 . . . . 0.0 108.051 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -50.77 131.6 34.3 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.223 2.615 . . . . 0.0 112.81 170.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 29.4 tp -68.28 108.14 3.08 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.033 0.933 . . . . 0.0 111.02 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -138.61 -13.15 1.3 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -54.48 -29.04 48.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.604 1.562 . . . . 0.0 114.382 -172.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -142.28 27.06 1.77 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.178 1.791 . . . . 0.0 111.769 169.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -143.42 39.04 1.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.692 2.397 . . . . 0.0 109.541 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.13 -24.03 2.51 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 117.033 2.235 . . . . 0.0 117.033 -168.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -132.34 20.51 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.635 1.574 . . . . 0.0 112.031 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -132.39 4.3 3.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.384 1.474 . . . . 0.0 113.29 -170.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -34.86 41.15 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.157 1.783 . . . . 0.0 114.705 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -130.86 151.08 51.68 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.533 1.933 . . . . 0.0 111.277 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.09 158.64 43.88 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.078 1.351 . . . . 0.0 112.493 -169.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -158.18 58.68 0.46 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.89 2.076 . . . . 0.0 109.006 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 9.7 m0 -59.91 -24.34 64.23 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 117.02 2.23 . . . . 0.0 117.02 -169.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 166.06 20.16 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.731 1.15 . . . . 0.0 113.791 -177.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -137.4 15.14 2.98 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.45 1.1 . . . . 0.0 112.638 169.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.51 7.6 0.25 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.879 1.271 . . . . 0.0 113.817 -171.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.76 169.44 13.85 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.479 1.511 . . . . 0.0 112.03 -172.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -138.61 140.92 39.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.565 1.946 . . . . 0.0 109.024 169.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.8 143.97 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 125.339 1.456 . . . . 0.0 110.258 -173.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -137.52 152.82 49.89 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.614 1.966 . . . . 0.0 109.728 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.5 tt -151.16 146.23 25.97 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.868 0.867 . . . . 0.0 111.98 -170.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.3 pp0? -149.14 156.71 40.18 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 125.408 1.483 . . . . 0.0 110.517 169.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -77.2 -16.13 25.61 Favored 'Cis proline' 0 CA--C 1.541 0.843 0 CA-C-N 120.355 1.163 . . . . 0.0 114.128 -0.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -70.08 151.57 45.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.57 1.148 . . . . 0.0 113.418 -175.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -63.45 119.3 52.26 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.896 1.678 . . . . 0.0 112.582 178.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -80.29 64.85 8.92 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.137 3.225 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -145.92 157.3 43.9 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.262 1.425 . . . . 0.0 111.587 -174.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -66.7 75.46 0.11 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.826 1.65 . . . . 0.0 113.872 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.9 t -75.85 159.15 31.28 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.653 1.981 . . . . 0.0 113.146 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.16 -8.59 55.55 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.317 1.447 . . . . 0.0 113.085 169.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -134.41 163.97 47.33 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 125.825 1.65 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.34 145.16 37.97 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 121.549 1.5 . . . . 0.0 110.466 168.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -73.91 -53.24 10.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.227 1.011 . . . . 0.0 111.017 173.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.0 t -81.92 140.31 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.667 1.187 . . . . 0.0 109.496 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 53.7 t -130.91 142.9 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.959 0.903 . . . . 0.0 111.07 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.99 127.42 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 127.784 2.433 . . . . 0.0 108.736 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.3 mt -89.12 156.9 18.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.394 0.616 . . . . 0.0 111.307 170.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.2 -21.77 60.0 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -71.16 -20.27 62.32 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.976 1.71 . . . . 0.0 113.575 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.62 3.3 62.75 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.897 1.237 . . . . 0.0 114.775 -177.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.02 147.09 28.37 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 118.455 1.127 . . . . 0.0 108.663 169.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.1 mm -131.42 155.89 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 124.935 1.294 . . . . 0.0 110.241 -168.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.7 p -55.67 129.6 70.74 Favored Pre-proline 0 N--CA 1.471 0.587 0 O-C-N 121.273 -0.892 . . . . 0.0 110.224 169.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -71.89 119.88 6.49 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.186 1.924 . . . . 0.0 111.456 175.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.479 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 13.1 p90 -149.84 174.74 12.32 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.229 1.811 . . . . 0.0 111.337 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 94.7 p -137.53 151.62 48.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.683 0.754 . . . . 0.0 111.118 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -139.76 128.32 22.99 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.281 1.832 . . . . 0.0 108.48 -169.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -123.24 150.96 42.78 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.611 1.565 . . . . 0.0 110.275 -173.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.5 mtt -129.67 142.13 50.78 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.873 1.269 . . . . 0.0 109.614 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.5 143.65 41.8 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.02 1.328 . . . . 0.0 111.046 -177.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.19 122.09 15.28 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.683 0.674 . . . . 0.0 110.133 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.07 -23.32 65.38 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -176.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -97.5 -48.67 1.95 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.766 1.174 . . . . 0.0 113.037 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.3 m -66.87 -31.28 71.78 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 117.951 0.875 . . . . 0.0 112.046 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.68 30.63 61.59 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 123.998 0.809 . . . . 0.0 113.665 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -133.36 149.35 72.17 Favored Pre-proline 0 N--CA 1.474 0.729 0 C-N-CA 125.873 1.669 . . . . 0.0 111.218 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.17 152.03 83.57 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.173 2.582 . . . . 0.0 112.2 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.76 -45.87 1.17 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 126.082 1.753 . . . . 0.0 112.36 -169.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.4 tp -151.66 154.74 36.97 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.33 1.452 . . . . 0.0 109.275 -173.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -146.38 144.79 29.98 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 123.856 0.862 . . . . 0.0 109.628 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.5 mt -126.0 136.38 52.92 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.561 2.345 . . . . 0.0 108.168 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.99 126.93 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.399 1.08 . . . . 0.0 110.708 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.479 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 43.4 t -93.82 -44.31 8.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -172.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 20.4 m 54.18 -5.54 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 -173.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.65 -1.5 3.97 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.342 1.448 . . . . 0.0 116.001 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 6.2 t -156.67 156.18 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.858 1.829 . . . . 0.0 114.88 -172.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.5 t-105 -61.18 137.53 94.27 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 125.812 1.645 . . . . 0.0 114.937 175.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -94.69 174.58 13.72 Favored 'Cis proline' 0 CA--C 1.546 1.09 0 CA-C-N 120.048 1.053 . . . . 0.0 110.487 -11.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.29 145.72 55.42 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.625 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -96.9 127.56 42.99 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.092 1.757 . . . . 0.0 110.555 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -96.17 143.66 27.08 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.526 1.53 . . . . 0.0 112.252 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.1 t -147.35 151.96 37.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.582 1.553 . . . . 0.0 111.334 170.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.57 132.62 44.92 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.48 64.34 0.11 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.939 2.096 . . . . 0.0 115.732 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 0.0 OUTLIER 48.58 15.44 0.09 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 128.655 2.782 . . . . 0.0 117.891 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.25 -39.49 79.29 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.4 m -86.53 -15.05 41.21 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.51 1.124 . . . . 0.0 112.836 178.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 48.9 ttt-85 -66.98 138.02 94.91 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 120.991 -1.068 . . . . 0.0 112.237 -171.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 123.629 2.886 . . . . 0.0 113.137 168.648 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.65 -36.15 78.21 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.311 -0.868 . . . . 0.0 112.6 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.3 t -73.55 -36.14 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.543 1.137 . . . . 0.0 110.584 173.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.86 70.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.605 1.162 . . . . 0.0 112.701 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.412 ' HA ' HD12 ' A' ' 121' ' ' LEU . 24.7 t-20 -57.83 -56.53 20.73 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.418 1.008 . . . . 0.0 112.418 169.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.4 m -58.9 -46.24 88.36 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.604 0.761 . . . . 0.0 111.297 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -65.96 -36.11 82.44 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 117.516 -1.231 . . . . 0.0 113.249 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.28 70.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.889 1.677 . . . . 0.0 110.978 171.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -61.89 -40.8 96.68 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.734 1.214 . . . . 0.0 111.973 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.7 tp10 -64.37 -50.19 68.65 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.265 1.426 . . . . 0.0 112.465 173.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 92.2 m -58.5 -37.17 75.02 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.173 1.389 . . . . 0.0 111.032 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.41 -44.93 70.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.666 1.187 . . . . 0.0 114.142 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.367 -0.833 . . . . 0.0 111.571 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -67.39 -39.42 85.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.736 0.815 . . . . 0.0 112.315 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.33 -39.85 92.06 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.094 0.861 . . . . 0.0 112.068 171.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.6 m -58.83 -42.09 88.44 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.57 -0.707 . . . . 0.0 110.827 174.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.21 -36.92 85.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.793 -1.192 . . . . 0.0 113.973 171.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.71 -32.91 73.88 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 120.774 -1.204 . . . . 0.0 113.321 174.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.9 tp -70.07 -34.73 73.56 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.192 -0.942 . . . . 0.0 111.637 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -62.6 -45.22 93.87 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.162 -0.961 . . . . 0.0 111.579 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.1 tp -53.98 -48.22 70.58 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.522 1.129 . . . . 0.0 111.542 170.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.14 -42.17 80.48 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 176.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.11 -45.19 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.195 -0.941 . . . . 0.0 111.123 172.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.42 -6.83 7.98 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.578 1.551 . . . . 0.0 113.884 174.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 57.4 mmt-85 -109.54 -31.36 7.53 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.932 1.293 . . . . 0.0 112.139 172.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.33 -33.49 74.79 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.037 1.289 . . . . 0.0 113.055 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 t -69.5 -15.34 63.23 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 173.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 67.7 mt -112.71 -30.9 6.92 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.554 1.542 . . . . 0.0 114.15 -173.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.6 m -77.59 -21.36 52.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -169.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.3 -5.19 60.53 Favored Glycine 0 CA--C 1.543 1.787 0 N-CA-C 115.284 0.874 . . . . 0.0 115.284 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -136.48 150.32 70.13 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 128.428 2.691 . . . . 0.0 106.566 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -45.9 151.49 1.38 Allowed 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.819 2.346 . . . . 0.0 112.815 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.4 t -113.49 160.25 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.224 1.41 . . . . 0.0 108.788 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.21 172.67 29.25 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 115.39 0.916 . . . . 0.0 115.39 -176.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.2 mt -134.77 113.99 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.902 1.281 . . . . 0.0 109.132 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -75.18 149.03 39.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.91 1.284 . . . . 0.0 110.008 169.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -136.8 139.35 41.71 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.326 1.45 . . . . 0.0 112.638 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.1 p -115.62 -175.49 2.73 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.248 1.819 . . . . 0.0 109.819 169.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.86 -10.37 37.52 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 173.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 94.5 p -146.15 -11.63 0.49 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -172.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -142.45 169.9 16.71 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.208 1.367 . . . . 0.0 112.47 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 35.6 p-90 -123.25 161.76 23.95 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.82 1.648 . . . . 0.0 110.323 171.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -146.71 121.7 10.04 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.176 1.39 . . . . 0.0 110.586 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.2 mm -80.94 138.39 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 95.0 mtp -137.69 144.36 41.75 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.153 0.981 . . . . 0.0 111.388 -171.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.7 m -140.61 166.31 23.95 Favored Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 127.478 2.311 . . . . 0.0 111.176 -169.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.62 167.61 9.69 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.0 2.467 . . . . 0.0 114.162 173.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.86 164.69 31.86 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.434 1.969 . . . . 0.0 110.256 169.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 85.1 tttt 59.38 -52.5 0.06 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 127.909 2.484 . . . . 0.0 115.469 -169.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 t -152.88 142.48 14.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 125.817 1.647 . . . . 0.0 112.208 -172.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -80.17 -16.65 10.92 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.435 2.757 . . . . 0.0 112.532 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 m -82.14 -5.89 58.78 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -169.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -146.95 150.33 34.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.891 1.276 . . . . 0.0 111.664 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -55.35 115.59 2.36 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.774 1.63 . . . . 0.0 112.088 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.3 tpt85 -153.29 154.47 34.67 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.519 1.528 . . . . 0.0 110.1 176.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -137.94 148.62 45.44 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.952 0.901 . . . . 0.0 112.823 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.4 t -150.79 144.44 17.26 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 129.633 3.173 . . . . 0.0 106.791 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -62.92 154.43 66.76 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 CA-C-N 121.795 1.677 . . . . 0.0 111.307 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.6 21.8 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -61.33 -10.22 6.73 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.02 -2.3 . . . . 0.0 114.023 177.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -65.92 -20.72 66.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.327 1.051 . . . . 0.0 113.061 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.87 -12.48 0.56 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -127.28 55.8 1.57 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.731 2.412 . . . . 0.0 108.091 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -39.88 -38.72 0.72 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 117.327 2.343 . . . . 0.0 117.327 -169.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -130.76 18.6 5.14 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.547 1.539 . . . . 0.0 112.033 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -136.85 1.51 2.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.786 1.635 . . . . 0.0 113.024 -170.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.1 p -60.85 -16.28 39.62 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.758 1.623 . . . . 0.0 115.08 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.94 138.92 39.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.357 1.463 . . . . 0.0 111.054 171.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -162.21 -179.99 7.47 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -142.97 166.2 25.29 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.769 2.428 . . . . 0.0 110.574 173.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -136.31 16.32 3.2 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -147.58 171.5 15.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.327 1.051 . . . . 0.0 113.168 -170.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -137.76 14.14 2.92 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.518 1.527 . . . . 0.0 111.715 169.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.47 11.55 0.79 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.979 1.712 . . . . 0.0 114.833 -172.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.4 mt -109.79 160.39 16.38 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.707 1.139 . . . . 0.0 112.879 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 64.5 m -134.79 124.41 25.11 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 127.229 2.212 . . . . 0.0 107.604 169.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -96.42 142.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.675 1.19 . . . . 0.0 109.983 -175.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -139.4 155.31 47.71 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.234 1.813 . . . . 0.0 109.74 175.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.0 mp -139.21 162.24 35.47 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.173 -0.954 . . . . 0.0 112.718 -177.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.17 145.87 14.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 126.144 1.778 . . . . 0.0 110.399 169.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -72.0 -9.58 15.84 Favored 'Cis proline' 0 CA--C 1.544 1.02 0 CA-C-N 120.575 1.241 . . . . 0.0 113.284 -8.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -64.22 173.6 1.92 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.816 1.647 . . . . 0.0 113.141 171.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -127.38 137.71 31.25 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.214 1.405 . . . . 0.0 111.191 -169.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -78.71 59.51 7.28 Favored 'Trans proline' 0 CA--C 1.549 1.254 0 C-N-CA 124.814 3.676 . . . . 0.0 112.097 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -151.43 148.04 27.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.936 1.294 . . . . 0.0 112.429 -173.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -77.85 82.61 4.22 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.352 1.072 . . . . 0.0 113.535 -177.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 64.1 p -68.02 8.6 0.39 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.147 2.179 . . . . 0.0 114.723 169.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.7 m120 60.77 21.39 11.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.664 1.986 . . . . 0.0 114.106 -175.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -145.98 168.26 12.17 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 126.891 2.076 . . . . 0.0 109.672 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.53 149.62 56.06 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 120.931 1.088 . . . . 0.0 111.388 169.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -77.46 -60.26 2.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.19 0.996 . . . . 0.0 109.883 170.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 41.0 t -84.42 142.13 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.278 1.431 . . . . 0.0 109.504 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 75.6 t -131.0 144.27 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 110.863 175.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -126.84 130.88 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.123 2.569 . . . . 0.0 109.342 -169.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.6 mt -94.13 157.05 16.25 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.428 0.632 . . . . 0.0 111.222 169.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.8 -24.36 56.9 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -71.49 -18.54 62.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.979 1.712 . . . . 0.0 113.468 176.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.72 6.0 62.57 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.575 1.083 . . . . 0.0 114.394 -175.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -84.35 142.4 30.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.416 1.108 . . . . 0.0 108.709 169.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -129.27 152.73 37.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 125.882 1.673 . . . . 0.0 110.12 -168.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.4 p -55.49 118.66 19.97 Favored Pre-proline 0 N--CA 1.471 0.6 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.259 169.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -68.42 126.46 14.24 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 121.946 1.764 . . . . 0.0 111.102 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -157.13 173.64 16.68 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.755 1.222 . . . . 0.0 112.951 -175.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -133.62 149.8 51.6 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.778 0.831 . . . . 0.0 111.053 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.1 tp -139.56 120.5 14.52 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.946 2.098 . . . . 0.0 108.364 -173.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -110.28 148.71 31.37 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.953 1.701 . . . . 0.0 110.455 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.6 mtt -126.38 134.29 51.08 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.294 1.438 . . . . 0.0 108.579 176.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -130.15 153.36 48.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.23 1.412 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.85 129.21 39.0 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.675 0.67 . . . . 0.0 110.022 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.56 -16.33 62.46 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -93.18 -53.86 1.82 Allowed Glycine 0 CA--C 1.533 1.189 0 C-N-CA 124.139 0.875 . . . . 0.0 113.101 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 63.1 p -79.03 -26.66 43.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.09 0.945 . . . . 0.0 113.283 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 76.8 3.73 80.52 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.885 1.231 . . . . 0.0 113.563 -169.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.65 131.36 61.19 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.767 1.284 . . . . 0.0 111.759 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.3 144.58 30.08 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.662 2.908 . . . . 0.0 114.273 172.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -121.71 -43.85 2.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.477 1.911 . . . . 0.0 112.071 -175.463 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -155.02 156.01 35.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.874 1.67 . . . . 0.0 108.876 -172.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.5 m -141.82 148.24 38.54 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.352 1.061 . . . . 0.0 109.426 171.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 37.0 mt -122.46 140.36 52.82 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.557 2.343 . . . . 0.0 107.64 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.2 t -143.56 130.1 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.71 0.804 . . . . 0.0 111.786 -169.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 36.0 t -117.22 115.12 24.69 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.206 1.403 . . . . 0.0 110.94 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -74.45 -10.01 59.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.447 1.099 . . . . 0.0 113.952 174.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 135.73 -0.65 3.42 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.949 1.262 . . . . 0.0 115.495 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 72.2 m -147.35 151.89 37.29 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.147 1.474 . . . . 0.0 113.301 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -60.34 135.58 91.4 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 125.469 1.508 . . . . 0.0 114.854 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -94.04 167.5 19.98 Favored 'Cis proline' 0 CA--C 1.545 1.073 0 CA-C-N 120.346 1.159 . . . . 0.0 110.398 -11.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . 0.258 0.1 OUTLIER -84.92 158.39 20.58 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.19 -0.944 . . . . 0.0 112.474 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -75.59 174.36 9.82 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.181 2.192 . . . . 0.0 113.78 -169.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -135.5 137.5 42.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.594 1.957 . . . . 0.0 110.34 169.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.8 t -152.93 162.91 40.72 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.897 1.279 . . . . 0.0 111.577 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -88.43 134.01 33.96 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.56 58.87 0.67 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.18 1.792 . . . . 0.0 115.086 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 62.54 11.06 4.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 127.209 2.204 . . . . 0.0 116.909 176.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.98 -29.47 63.28 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -169.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 81.3 p -91.92 -9.62 42.51 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.52 14.59 Favored Pre-proline 0 N--CA 1.478 0.95 0 CA-C-O 116.202 -1.856 . . . . 0.0 115.835 -174.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 C--O 1.25 1.113 0 C-N-CA 123.971 3.114 . . . . 0.0 115.18 176.776 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.61 -39.76 80.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.865 0.757 . . . . 0.0 112.629 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.46 -41.68 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.754 0.822 . . . . 0.0 110.318 176.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -49.31 78.05 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.471 0.709 . . . . 0.0 111.903 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.24 -35.35 78.66 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.306 0.957 . . . . 0.0 112.666 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.4 m -61.95 -53.22 58.73 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.016 0.826 . . . . 0.0 111.219 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -61.17 -33.33 73.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.206 1.002 . . . . 0.0 112.885 177.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.2 90.18 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.379 1.072 . . . . 0.0 113.01 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.3 mtt-85 -63.93 -42.27 97.41 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.966 0.906 . . . . 0.0 110.841 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.8 -46.23 86.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.986 0.914 . . . . 0.0 112.26 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.1 m -59.69 -42.45 93.02 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.923 1.289 . . . . 0.0 111.252 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.71 77.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.346 1.058 . . . . 0.0 113.681 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.15 97.04 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.314 -0.866 . . . . 0.0 111.537 173.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 52.4 tpt85 -64.02 -39.33 93.85 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.324 1.05 . . . . 0.0 112.427 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.82 -43.32 93.48 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.47 1.108 . . . . 0.0 113.022 170.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.1 m -60.11 -43.17 95.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.228 0.611 . . . . 0.0 110.416 176.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.97 94.97 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.069 -1.019 . . . . 0.0 113.49 171.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.7 -36.38 83.46 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.181 -0.949 . . . . 0.0 113.246 176.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.6 tp -71.45 -33.64 69.53 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.418 1.087 . . . . 0.0 111.603 174.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.02 -44.46 96.67 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.055 -1.028 . . . . 0.0 111.334 169.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -45.26 62.78 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.467 1.507 . . . . 0.0 111.74 169.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.7 -45.18 87.7 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 176.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 59.8 mt -61.65 -45.21 99.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.526 1.131 . . . . 0.0 110.831 177.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.02 -27.94 69.23 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.649 1.18 . . . . 0.0 113.271 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -92.78 -30.27 15.57 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.08 -29.92 67.69 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.2 t -77.72 -14.64 59.55 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 173.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.3 mt -106.14 -37.14 6.69 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.302 1.441 . . . . 0.0 113.651 -172.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.4 m -85.6 -7.91 58.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -173.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.17 -1.87 88.48 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 115.384 0.914 . . . . 0.0 115.384 170.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -142.15 148.36 47.87 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 127.167 2.187 . . . . 0.0 107.843 171.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -44.63 152.6 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.721 2.947 . . . . 0.0 113.942 168.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.26 161.84 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.673 1.589 . . . . 0.0 108.105 175.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.14 173.07 34.08 Favored Glycine 0 N--CA 1.465 0.615 0 CA-C-N 120.118 1.326 . . . . 0.0 115.473 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.9 mt -136.62 123.48 31.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 C-N-CA 124.583 1.153 . . . . 0.0 109.18 -177.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -88.92 151.73 22.15 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.882 1.673 . . . . 0.0 110.605 171.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -141.14 144.73 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.179 1.392 . . . . 0.0 112.676 -173.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.4 p -128.03 179.69 5.44 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.772 1.629 . . . . 0.0 110.589 170.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.7 1.45 12.29 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 121.313 -0.867 . . . . 0.0 113.254 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -138.27 -21.21 1.06 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -173.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.33 175.82 12.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.061 1.345 . . . . 0.0 112.144 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 26.7 p90 -139.0 147.8 42.62 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 126.006 1.722 . . . . 0.0 109.069 175.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -141.65 113.59 7.94 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.233 1.413 . . . . 0.0 111.284 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.0 mt -78.57 137.53 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 24.1 mtm -134.07 155.27 50.32 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.977 1.311 . . . . 0.0 110.885 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.4 p -147.18 161.76 35.3 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.654 1.182 . . . . 0.0 110.956 -168.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -59.72 144.03 99.52 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.627 2.218 . . . . 0.0 112.567 169.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -131.44 -13.67 1.85 Allowed Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.574 1.083 . . . . 0.0 115.24 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -158.21 153.45 25.69 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.298 2.239 . . . . 0.0 108.803 174.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . 0.261 15.3 t 33.4 68.06 1.05 Allowed Pre-proline 0 N--CA 1.483 1.196 0 C-N-CA 126.457 1.903 . . . . 0.0 115.999 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -52.41 -24.68 22.32 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.09 2.527 . . . . 0.0 113.949 170.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -57.12 -14.86 4.38 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.879 2.072 . . . . 0.0 115.141 171.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.28 -108.91 0.26 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.374 1.469 . . . . 0.0 111.263 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -154.05 119.59 5.19 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.236 1.414 . . . . 0.0 110.731 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.1 tpt85 -153.52 153.23 32.02 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.505 1.522 . . . . 0.0 110.384 173.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -136.42 147.06 47.07 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.453 1.101 . . . . 0.0 111.486 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -149.04 144.15 17.77 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 126.944 2.098 . . . . 0.0 108.363 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.66 131.75 42.8 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 122.745 2.296 . . . . 0.0 112.683 171.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.9 tp -67.54 99.06 0.72 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.853 1.261 . . . . 0.0 111.098 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -139.97 -7.08 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -171.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.84 -27.59 52.26 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.651 1.18 . . . . 0.0 114.142 -173.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -139.46 31.0 2.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.975 1.71 . . . . 0.0 110.897 169.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -148.61 45.15 1.03 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.849 2.46 . . . . 0.0 109.082 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.2 123.06 8.69 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.956 1.303 . . . . 0.0 112.937 -169.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.1 t70 57.66 11.21 1.22 Allowed 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 -177.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -123.32 26.98 7.7 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.408 -1.432 . . . . 0.0 113.784 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.9 p -62.66 -40.01 95.71 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.093 0.957 . . . . 0.0 112.434 169.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.16 139.96 30.62 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.333 1.053 . . . . 0.0 110.707 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -138.96 157.76 45.43 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -169.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -156.76 53.36 0.52 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.776 2.03 . . . . 0.0 110.037 -169.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 15.8 m0 -60.78 18.3 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.619 2.768 . . . . 0.0 118.358 -169.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -144.91 179.37 7.38 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.375 -1.453 . . . . 0.0 113.671 -173.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -137.23 16.82 2.98 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.51 1.524 . . . . 0.0 112.852 175.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.67 -1.26 0.7 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.8 mt -119.64 163.53 17.24 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.967 1.365 . . . . 0.0 114.436 -169.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.0 t -136.29 129.31 31.27 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 128.237 2.615 . . . . 0.0 106.949 168.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.83 137.59 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.648 1.179 . . . . 0.0 109.61 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -133.24 132.01 40.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.916 1.286 . . . . 0.0 109.58 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -116.85 145.23 43.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.691 1.196 . . . . 0.0 111.846 -169.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -145.45 151.41 47.14 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.476 1.91 . . . . 0.0 110.495 -172.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -75.92 -15.33 24.31 Favored 'Cis proline' 0 CA--C 1.543 0.953 0 CA-C-N 120.244 1.123 . . . . 0.0 112.337 -10.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -64.63 133.82 53.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.652 . . . . 0.0 111.868 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.14 147.51 90.62 Favored Pre-proline 0 CA--C 1.547 0.833 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 176.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -71.42 142.28 40.49 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.723 2.282 . . . . 0.0 109.588 169.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -154.99 -159.21 0.92 Allowed 'General case' 0 CA--C 1.549 0.936 0 O-C-N 121.507 -0.745 . . . . 0.0 112.221 -171.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -143.07 41.79 1.53 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.485 2.714 . . . . 0.0 108.106 168.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 34.9 t -65.9 154.49 39.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.764 2.026 . . . . 0.0 114.214 -169.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -69.98 -9.37 54.95 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 113.316 169.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -126.06 161.13 53.48 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 125.046 1.339 . . . . 0.0 111.548 176.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.51 158.62 43.88 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.376 2.051 . . . . 0.0 112.062 169.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -87.94 -28.93 21.19 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.692 0.797 . . . . 0.0 111.061 169.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -113.21 134.74 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.994 1.317 . . . . 0.0 109.826 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 87.6 t -133.0 140.79 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.408 1.083 . . . . 0.0 110.775 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -118.7 120.23 63.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 127.304 2.241 . . . . 0.0 108.652 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.5 mt -89.21 158.65 17.8 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.129 0.966 . . . . 0.0 111.742 176.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.17 -23.0 53.78 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -106.77 7.39 30.31 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.726 1.211 . . . . 0.0 113.932 -172.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 100.01 12.4 39.96 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 115.559 0.984 . . . . 0.0 115.559 172.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.54 ' C ' HD12 ' A' ' 105' ' ' ILE . 10.7 pt20 -98.78 140.34 33.11 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.614 1.207 . . . . 0.0 109.848 169.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.54 HD12 ' C ' ' A' ' 104' ' ' GLN . 2.9 mp -133.76 143.83 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.757 1.623 . . . . 0.0 108.068 -169.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 p -50.16 123.15 15.81 Favored Pre-proline 0 N--CA 1.475 0.779 0 C-N-CA 124.328 1.051 . . . . 0.0 111.613 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.76 123.5 13.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.675 2.25 . . . . 0.0 112.929 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.472 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.2 p90 -152.21 174.24 14.0 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.388 1.475 . . . . 0.0 111.36 176.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 65.7 m -145.94 146.57 31.1 Favored 'General case' 0 C--N 1.33 -0.251 0 O-C-N 121.307 -0.871 . . . . 0.0 111.373 172.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.2 tp -129.2 124.47 34.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 127.641 2.377 . . . . 0.0 108.392 -169.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -120.19 144.86 47.48 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.492 1.117 . . . . 0.0 110.118 -177.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.1 mtt -123.06 129.99 52.2 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 109.629 -178.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.11 138.68 52.62 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.187 1.395 . . . . 0.0 111.088 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -57.92 123.62 16.43 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.989 1.316 . . . . 0.0 111.535 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -17.81 54.92 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -116.82 -45.03 0.56 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.09 1.329 . . . . 0.0 113.943 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.0 m -73.3 -25.65 60.74 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.679 1.239 . . . . 0.0 112.338 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.9 33.35 57.68 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.022 0.82 . . . . 0.0 113.984 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -136.71 139.59 29.55 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.287 1.435 . . . . 0.0 111.375 -169.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -52.14 146.57 30.19 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.942 3.095 . . . . 0.0 114.626 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.07 -8.71 1.02 Allowed 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.448 HD21 HE21 ' A' ' 134' ' ' GLN . 7.0 tp -163.07 152.71 15.42 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.42 1.488 . . . . 0.0 110.308 175.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 1.1 m -139.71 146.24 39.35 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.642 1.577 . . . . 0.0 108.781 169.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.59 139.17 53.82 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.745 2.418 . . . . 0.0 108.829 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.9 t -137.01 128.44 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.46 0.704 . . . . 0.0 112.328 -170.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.472 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 52.7 t -105.64 109.41 21.36 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.305 1.442 . . . . 0.0 109.977 172.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 63.7 p -74.04 -17.35 60.98 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 143.58 -8.12 2.03 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.068 1.318 . . . . 0.0 115.034 -177.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.5 p -153.99 161.05 42.25 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.214 1.507 . . . . 0.0 113.899 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -61.73 137.89 95.19 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 125.95 1.7 . . . . 0.0 115.533 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -94.64 177.67 10.75 Favored 'Cis proline' 0 CA--C 1.547 1.157 0 CA-C-N 120.032 1.047 . . . . 0.0 110.513 -11.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.32 153.88 41.48 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.073 -1.017 . . . . 0.0 111.757 171.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -88.26 161.39 17.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.372 1.469 . . . . 0.0 109.505 169.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.448 HE21 HD21 ' A' ' 122' ' ' LEU . 55.5 tt0 -138.26 140.63 39.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.621 1.568 . . . . 0.0 111.247 -169.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 2.4 t -150.36 157.46 43.07 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.81 2.044 . . . . 0.0 109.703 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -82.57 -12.31 57.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -169.56 65.94 0.05 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.152 1.381 . . . . 0.0 114.044 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.07 12.31 2.37 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 116.904 2.187 . . . . 0.0 116.904 171.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.23 -28.9 69.49 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 120.715 1.598 . . . . 0.0 113.822 -177.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 36.0 p -89.18 3.37 52.15 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.059 1.744 . . . . 0.0 113.743 175.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -115.85 85.15 14.05 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 125.99 1.716 . . . . 0.0 111.399 -170.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--O 1.25 1.091 0 C-N-CA 123.07 2.514 . . . . 0.0 112.093 172.099 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.49 -33.8 75.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 39.0 t -73.58 -44.08 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.843 0.857 . . . . 0.0 110.199 175.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.55 95.75 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 118.772 0.714 . . . . 0.0 111.904 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -56.58 -48.85 76.48 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.072 1.349 . . . . 0.0 112.509 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 176.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -59.09 -40.98 86.96 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.262 -0.875 . . . . 0.0 112.66 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.67 83.69 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.955 1.252 . . . . 0.0 111.886 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -68.32 -39.38 82.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.454 1.102 . . . . 0.0 111.457 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.57 -44.57 90.28 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.121 0.568 . . . . 0.0 112.219 171.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.1 m -60.08 -38.63 83.47 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.866 1.267 . . . . 0.0 111.589 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -44.25 81.0 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 173.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.5 98.64 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 121.349 -0.844 . . . . 0.0 112.034 174.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -60.84 -47.72 85.07 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.834 1.254 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -58.59 -43.39 89.49 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 174.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -57.84 -43.01 85.58 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.06 0.845 . . . . 0.0 111.021 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.32 89.33 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.882 -1.136 . . . . 0.0 113.722 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.84 -31.2 71.66 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.972 -1.08 . . . . 0.0 113.46 176.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 tp -70.23 -35.98 74.22 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.376 1.07 . . . . 0.0 111.498 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.43 -44.73 95.72 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.12 -0.987 . . . . 0.0 111.653 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 tp -53.67 -48.1 69.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.614 1.166 . . . . 0.0 111.393 169.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.84 -38.48 85.63 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.9 mt -64.95 -46.21 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.953 0.901 . . . . 0.0 110.935 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.81 -40.89 89.89 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.8 -0.563 . . . . 0.0 112.115 175.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -67.31 -41.61 85.06 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.464 -0.772 . . . . 0.0 112.398 173.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.07 -38.11 87.57 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.948 1.249 . . . . 0.0 112.605 176.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.38 -24.19 50.63 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.959 -0.463 . . . . 0.0 112.17 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -32.92 17.71 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.08 0.952 . . . . 0.0 113.122 177.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.9 m -79.99 -21.45 43.62 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -169.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.54 8.5 87.61 Favored Glycine 0 CA--C 1.541 1.709 0 CA-C-N 118.82 0.736 . . . . 0.0 114.616 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -144.99 149.06 41.03 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 127.584 2.354 . . . . 0.0 107.595 171.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.06 160.3 0.29 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.485 2.79 . . . . 0.0 113.719 168.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.1 t -127.56 162.24 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 126.629 1.971 . . . . 0.0 109.099 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.58 178.64 28.78 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 115.216 0.846 . . . . 0.0 115.216 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -133.59 116.63 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.793 1.237 . . . . 0.0 109.358 -172.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -85.36 68.46 10.48 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.877 2.071 . . . . 0.0 110.851 -176.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -61.65 153.1 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.716 0.806 . . . . 0.0 113.075 169.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 p -139.37 -177.05 4.75 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.308 2.243 . . . . 0.0 109.77 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -57.76 -21.98 44.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 173.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m -138.39 -4.08 1.68 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -171.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.42 176.17 10.24 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 122.361 1.077 . . . . 0.0 113.409 -176.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -154.55 161.58 41.56 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.821 2.448 . . . . 0.0 108.49 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.7 148.33 1.12 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.741 2.016 . . . . 0.0 109.879 169.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.6 mm -73.29 147.23 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.058 0.543 . . . . 0.0 109.756 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 61.6 mtp -128.65 134.58 48.57 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.094 1.358 . . . . 0.0 108.804 169.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -134.71 160.04 69.91 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 125.39 1.476 . . . . 0.0 109.878 -168.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -63.39 -24.78 71.13 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.25 1.967 . . . . 0.0 115.135 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.91 -52.76 0.05 OUTLIER Glycine 0 CA--C 1.54 1.608 0 C-N-CA 129.219 3.295 . . . . 0.0 116.738 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -144.03 -18.11 0.58 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 128.164 2.586 . . . . 0.0 112.689 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 p -131.1 69.59 82.41 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 125.099 1.36 . . . . 0.0 113.161 -169.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -71.0 27.77 0.21 Allowed 'Trans proline' 0 CA--C 1.55 1.305 0 C-N-CA 124.974 3.783 . . . . 0.0 113.763 173.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 m -71.14 -35.19 71.6 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.073 1.749 . . . . 0.0 113.932 -170.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -173.22 -44.55 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.631 1.572 . . . . 0.0 112.98 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -148.53 -66.76 0.23 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.174 0.99 . . . . 0.0 112.67 -172.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -12.41 87.73 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 129.226 3.01 . . . . 0.0 115.547 -172.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -73.69 161.03 30.71 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 36.0 t -139.72 134.48 16.12 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 128.022 2.529 . . . . 0.0 107.205 170.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -65.04 133.58 36.25 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.049 1.833 . . . . 0.0 110.167 174.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -76.46 82.02 3.17 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.802 0.811 . . . . 0.0 111.075 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -132.21 17.82 4.5 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.325 1.85 . . . . 0.0 112.584 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -58.66 -24.04 60.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.746 1.218 . . . . 0.0 114.088 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -145.43 -33.31 0.36 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.731 1.613 . . . . 0.0 112.36 173.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.9 28.36 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.989 1.715 . . . . 0.0 113.922 169.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.6 -25.55 10.96 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.617 1.967 . . . . 0.0 116.101 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -132.05 18.41 4.55 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.063 1.745 . . . . 0.0 112.603 175.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -136.86 -2.01 2.16 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.505 1.522 . . . . 0.0 113.617 -173.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 79.7 p -65.12 -14.32 60.26 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -176.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -135.11 162.25 33.02 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.752 1.221 . . . . 0.0 113.997 -172.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.289 48.2 t-20 40.75 -114.57 0.21 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.945 2.098 . . . . 0.0 113.434 -168.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.5 t70 56.34 8.07 0.39 Allowed 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 125.906 1.683 . . . . 0.0 114.825 -169.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 49.8 m0 -115.42 -33.76 5.16 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.621 -1.3 . . . . 0.0 112.935 -170.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 169.07 23.32 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -142.03 25.5 1.93 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.987 1.715 . . . . 0.0 111.097 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -143.33 -1.62 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -169.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 52.0 mt -117.06 165.24 13.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -169.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -133.94 131.43 39.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 128.794 2.838 . . . . 0.0 107.341 169.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -103.37 142.47 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 124.817 1.247 . . . . 0.0 109.468 -174.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -139.24 149.38 44.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.581 1.552 . . . . 0.0 109.547 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 83.9 mt -132.42 160.46 36.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.014 0.925 . . . . 0.0 112.727 -171.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.55 142.83 13.11 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.823 1.649 . . . . 0.0 110.029 169.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -73.19 -8.28 18.15 Favored 'Cis proline' 0 CA--C 1.547 1.155 0 CA-C-N 120.419 1.185 . . . . 0.0 113.516 -9.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -64.48 173.68 2.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.133 1.773 . . . . 0.0 112.891 174.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -118.16 134.39 23.36 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.228 1.411 . . . . 0.0 112.224 -175.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -78.59 74.25 5.53 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 124.123 3.215 . . . . 0.0 111.256 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -136.42 144.87 44.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.573 1.149 . . . . 0.0 111.567 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -76.34 56.17 1.05 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.351 1.461 . . . . 0.0 111.627 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.7 p -65.51 -6.46 10.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 128.479 2.712 . . . . 0.0 117.083 -169.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.68 26.08 15.84 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 113.97 -170.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -142.66 165.59 25.78 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 125.546 1.538 . . . . 0.0 109.775 169.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.96 142.74 69.91 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 121.437 1.425 . . . . 0.0 113.226 171.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.31 -13.22 18.91 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.851 2.061 . . . . 0.0 112.297 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -133.36 141.16 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.154 1.782 . . . . 0.0 108.019 173.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.4 t -133.18 144.26 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.487 1.115 . . . . 0.0 110.815 -174.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -130.2 121.16 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 127.948 2.499 . . . . 0.0 108.934 -169.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.5 157.81 31.8 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.988 1.315 . . . . 0.0 111.236 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.79 -7.81 5.69 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -178.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -115.56 8.31 15.09 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.724 1.61 . . . . 0.0 112.989 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.35 8.96 67.66 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 115.321 0.888 . . . . 0.0 115.321 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -78.84 144.4 35.05 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 169.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.3 mm -130.79 126.8 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.289 1.036 . . . . 0.0 108.763 -169.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 79.1 m -57.71 113.16 5.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -178.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -50.74 133.55 39.27 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 124.174 3.25 . . . . 0.0 115.839 -170.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.408 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.9 p90 -165.23 176.69 8.19 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.761 2.025 . . . . 0.0 111.4 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.0 t -141.15 146.15 36.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.633 1.173 . . . . 0.0 109.216 168.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tp -131.11 120.78 23.86 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 126.72 2.008 . . . . 0.0 108.704 -169.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.5 tt -112.11 148.34 34.17 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.485 1.514 . . . . 0.0 110.047 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 70.5 mtm -132.12 137.73 47.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.349 1.06 . . . . 0.0 109.372 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.42 155.89 49.82 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.94 1.696 . . . . 0.0 110.184 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -63.3 132.75 52.61 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 119.009 0.822 . . . . 0.0 110.327 173.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.21 -33.07 67.14 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -175.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.36 -47.44 3.79 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 119.016 0.825 . . . . 0.0 114.314 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.5 p -80.35 -28.05 38.17 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.81 7.57 70.33 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.887 0.756 . . . . 0.0 112.939 -169.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -71.15 128.22 90.65 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.969 1.307 . . . . 0.0 110.494 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.51 149.49 87.66 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.544 2.163 . . . . 0.0 112.008 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.25 -47.95 1.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.808 1.643 . . . . 0.0 111.884 -172.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.46 HD23 ' N ' ' A' ' 123' ' ' THR . 5.3 tt -153.31 149.0 27.43 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.391 1.476 . . . . 0.0 108.799 -169.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . 0.46 ' N ' HD23 ' A' ' 122' ' ' LEU . 8.0 m -139.88 143.62 36.79 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.964 0.906 . . . . 0.0 110.085 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.3 mt -122.78 148.0 45.87 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 127.047 2.139 . . . . 0.0 108.675 -178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.7 t -142.84 135.86 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.284 0.634 . . . . 0.0 111.788 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.408 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 30.7 t -113.83 151.57 31.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.925 1.29 . . . . 0.0 111.581 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -128.64 -0.44 5.49 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.758 1.623 . . . . 0.0 113.787 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.24 -13.1 5.21 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.819 1.199 . . . . 0.0 115.381 176.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.6 t -153.04 156.07 38.06 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.478 1.639 . . . . 0.0 113.48 -174.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -55.98 137.99 72.46 Favored Pre-proline 0 CA--C 1.552 1.047 0 C-N-CA 126.738 2.015 . . . . 0.0 115.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -96.17 178.39 8.69 Favored 'Cis proline' 0 CA--C 1.55 1.283 0 CA-C-N 120.099 1.071 . . . . 0.0 110.793 -11.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.03 159.61 30.43 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.041 -1.037 . . . . 0.0 112.159 169.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -90.8 168.43 11.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.881 1.672 . . . . 0.0 109.902 169.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.455 ' HG3' HD21 ' A' ' 122' ' ' LEU . 56.1 tt0 -143.79 141.88 30.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.254 1.821 . . . . 0.0 111.847 -169.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.2 t -153.72 162.8 40.93 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.275 1.43 . . . . 0.0 111.116 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -84.75 137.12 33.39 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.593 -0.692 . . . . 0.0 109.155 170.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 23.87 65.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 127.556 2.342 . . . . 0.0 116.317 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 58.3 mtm180 57.25 9.67 0.74 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 118.043 2.608 . . . . 0.0 118.043 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -56.78 -20.73 23.94 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.467 1.485 . . . . 0.0 114.948 -175.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.83 12.29 6.23 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.596 1.558 . . . . 0.0 113.052 175.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -74.74 135.27 74.78 Favored Pre-proline 0 N--CA 1.482 1.128 0 O-C-N 120.442 -1.412 . . . . 0.0 110.032 176.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 C--O 1.249 1.069 0 C-N-CA 122.935 2.423 . . . . 0.0 113.318 171.188 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 N--CA 1.473 0.694 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -67.8 -45.51 74.59 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.889 0.875 . . . . 0.0 112.602 -176.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.8 t -63.59 -46.03 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.564 0.745 . . . . 0.0 110.44 173.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.06 78.99 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.481 0.582 . . . . 0.0 112.329 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.75 -42.85 97.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.279 0.945 . . . . 0.0 111.992 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -60.62 -46.95 88.35 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.601 1.091 . . . . 0.0 111.402 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -61.31 -36.07 79.12 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.303 -0.856 . . . . 0.0 112.474 172.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.5 88.19 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.68 1.127 . . . . 0.0 112.763 175.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -61.74 -41.28 97.44 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.497 0.719 . . . . 0.0 111.271 178.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -64.73 -52.74 55.5 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.018 0.527 . . . . 0.0 111.945 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.5 m -52.82 -41.02 63.81 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.382 1.473 . . . . 0.0 111.559 177.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.72 -48.22 69.9 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.711 1.205 . . . . 0.0 113.593 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.93 -42.46 94.01 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.663 0.665 . . . . 0.0 112.34 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -68.52 -38.01 80.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.165 0.586 . . . . 0.0 111.226 175.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -58.71 -43.85 90.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.055 -0.974 . . . . 0.0 112.724 172.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -44.31 83.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.642 1.564 . . . . 0.0 111.988 173.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.05 -39.7 94.65 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.349 0.977 . . . . 0.0 113.099 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.96 78.57 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.089 0.956 . . . . 0.0 113.25 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.54 -36.9 71.14 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 0.0 111.359 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.52 -44.27 96.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.963 -1.085 . . . . 0.0 111.533 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.0 tp -53.07 -45.92 68.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.198 1.399 . . . . 0.0 111.419 169.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.23 -42.04 98.95 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 176.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 75.2 mt -61.89 -47.14 94.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.877 0.871 . . . . 0.0 110.528 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.82 -34.08 75.3 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.867 0.867 . . . . 0.0 113.019 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.0 ttt85 -79.05 -35.05 43.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.667 0.787 . . . . 0.0 113.023 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.34 -25.1 67.71 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -176.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.0 t -77.55 -14.29 59.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 171.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 76.8 mt -108.01 -30.88 8.21 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.009 1.723 . . . . 0.0 113.09 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.8 p -69.23 -29.79 67.81 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.548 1.939 . . . . 0.0 115.088 -176.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.99 83.04 Favored Glycine 0 CA--C 1.542 1.729 0 C-N-CA 124.895 1.236 . . . . 0.0 114.875 -176.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -145.42 145.76 27.45 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 127.247 2.219 . . . . 0.0 107.985 171.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -40.73 139.01 1.38 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.275 2.65 . . . . 0.0 112.955 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.5 t -91.13 162.7 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.47 1.508 . . . . 0.0 108.786 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -146.82 169.41 27.95 Favored Glycine 0 CA--C 1.521 0.447 0 O-C-N 120.914 -1.116 . . . . 0.0 114.637 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.7 mt -136.06 116.6 18.08 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 125.001 1.32 . . . . 0.0 107.5 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -78.6 153.61 30.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.958 1.303 . . . . 0.0 110.688 170.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -141.2 142.54 33.98 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.254 1.822 . . . . 0.0 111.303 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 t -144.34 175.53 10.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.997 1.719 . . . . 0.0 111.26 -176.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -49.07 -29.77 5.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.501 1.921 . . . . 0.0 115.816 -169.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 82.4 p -140.97 14.62 2.27 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.023 1.329 . . . . 0.0 113.586 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.08 171.66 17.52 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.759 1.266 . . . . 0.0 114.355 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -138.28 160.26 39.93 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 127.771 2.428 . . . . 0.0 107.868 169.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -154.19 125.5 7.42 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.797 1.239 . . . . 0.0 110.885 -176.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 16.9 mm -72.82 142.42 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.207 -178.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -137.15 151.2 48.54 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.801 1.241 . . . . 0.0 112.25 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -145.45 167.94 13.18 Favored Pre-proline 0 N--CA 1.478 0.948 0 C-N-CA 126.248 1.819 . . . . 0.0 111.277 -169.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -60.79 -23.82 77.46 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.184 2.589 . . . . 0.0 115.866 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.12 -145.32 49.05 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 121.631 -0.668 . . . . 0.0 111.858 -169.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -73.21 1.15 9.88 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 116.635 2.087 . . . . 0.0 116.635 -174.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.6 p -125.47 38.73 0.42 Allowed Pre-proline 0 N--CA 1.485 1.309 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -61.56 -15.07 39.1 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.098 2.532 . . . . 0.0 115.282 -169.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -60.88 -15.21 28.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.455 1.502 . . . . 0.0 114.45 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -145.03 166.91 23.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.901 1.68 . . . . 0.0 111.9 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -63.62 117.91 7.48 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.052 0.941 . . . . 0.0 111.897 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -154.05 160.11 41.85 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.651 1.58 . . . . 0.0 110.528 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -139.79 142.92 36.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.665 1.186 . . . . 0.0 112.52 174.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -150.83 145.14 17.92 Favored Pre-proline 0 N--CA 1.47 0.561 0 C-N-CA 126.099 1.759 . . . . 0.0 109.126 169.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.22 147.18 36.51 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.511 2.141 . . . . 0.0 111.794 169.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.68 12.72 0.12 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -178.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -61.62 -18.41 59.33 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.175 -1.578 . . . . 0.0 113.698 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.44 -18.85 65.64 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -145.83 -16.07 0.47 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -120.43 13.58 11.84 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.04 1.336 . . . . 0.0 112.264 169.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 53.41 -168.64 0.06 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.636 2.375 . . . . 0.0 114.443 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -55.47 -16.6 3.92 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.291 -1.505 . . . . 0.0 113.967 173.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.35 3.15 9.57 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.754 2.021 . . . . 0.0 113.858 174.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -62.54 16.74 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.793 2.037 . . . . 0.0 115.367 174.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -146.73 175.18 10.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.005 1.722 . . . . 0.0 114.305 -169.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -51.48 134.2 29.18 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -173.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -150.87 16.67 0.77 Allowed 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 127.116 2.166 . . . . 0.0 111.44 169.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -88.83 -9.36 51.99 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 -169.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.7 171.79 13.58 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -136.53 9.52 3.15 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.374 1.87 . . . . 0.0 112.301 175.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -157.15 15.8 0.27 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -169.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 68.7 mt -110.66 152.96 25.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.251 -1.531 . . . . 0.0 114.102 -177.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.7 t -131.23 134.94 46.93 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.769 2.827 . . . . 0.0 106.779 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -112.12 139.07 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 125.311 1.445 . . . . 0.0 110.323 -169.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -139.14 123.31 18.0 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.163 1.385 . . . . 0.0 110.747 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.8 mp -106.25 157.22 17.75 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.33 1.062 . . . . 0.0 112.739 -177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.92 126.66 7.27 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.775 2.03 . . . . 0.0 108.846 -174.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -75.99 -9.28 27.14 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.333 1.155 . . . . 0.0 113.605 -8.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -70.29 152.15 44.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.248 1.419 . . . . 0.0 113.972 -170.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.54 120.94 80.51 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.249 1.42 . . . . 0.0 113.453 179.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -79.68 63.12 8.7 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.3 3.333 . . . . 0.0 111.098 170.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -157.86 154.19 27.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.0 1.72 . . . . 0.0 110.515 -174.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -56.26 66.18 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.837 2.855 . . . . 0.0 116.925 -173.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.9 t -62.9 158.33 19.35 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.851 2.06 . . . . 0.0 113.479 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -71.07 -7.01 43.52 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.168 1.387 . . . . 0.0 113.46 171.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -136.44 161.76 60.25 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.748 1.619 . . . . 0.0 111.449 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.71 142.86 44.76 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 121.628 1.552 . . . . 0.0 110.17 168.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -72.44 -22.55 61.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.471 1.109 . . . . 0.0 112.31 174.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.5 t -123.17 135.46 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.031 1.333 . . . . 0.0 109.989 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 91.9 t -131.03 144.14 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.584 1.154 . . . . 0.0 110.526 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.3 mp -128.54 123.53 59.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 127.5 2.32 . . . . 0.0 110.184 -169.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.8 mt -83.16 160.82 21.75 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.082 0.944 . . . . 0.0 112.368 175.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.14 62.81 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.899 1.279 . . . . 0.0 113.604 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -93.72 16.17 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.201 1.801 . . . . 0.0 112.555 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 68.97 11.62 63.67 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.658 -1.276 . . . . 0.0 115.279 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.69 143.66 34.4 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.7 mm -132.84 143.41 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.193 1.397 . . . . 0.0 108.847 -171.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.1 p -53.07 127.84 46.83 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.252 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.63 127.55 12.53 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.356 2.038 . . . . 0.0 111.344 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.53 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.2 p90 -160.31 173.76 15.2 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.236 2.214 . . . . 0.0 110.433 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.2 m -135.2 145.88 48.13 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.69 0.796 . . . . 0.0 110.894 169.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -135.52 113.8 11.47 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.692 1.997 . . . . 0.0 108.997 -169.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.7 tt -104.53 146.16 29.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.611 1.564 . . . . 0.0 110.159 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.8 mtt -119.11 133.39 55.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.955 1.302 . . . . 0.0 109.595 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -131.14 139.95 49.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.513 1.525 . . . . 0.0 111.001 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 34.8 t-20 -57.35 119.44 6.47 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.127 1.371 . . . . 0.0 111.259 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.22 -17.63 58.83 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.86 -47.21 0.91 Allowed Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.657 1.122 . . . . 0.0 113.395 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.8 m -76.63 -23.63 53.36 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.978 0.911 . . . . 0.0 112.916 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 71.08 37.0 64.13 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.41 1.005 . . . . 0.0 113.858 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -137.83 136.5 20.0 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 125.203 1.401 . . . . 0.0 111.364 -169.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -53.49 149.51 30.47 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.156 3.238 . . . . 0.0 115.184 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.65 -10.72 0.81 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 176.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -167.68 157.14 10.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.459 1.904 . . . . 0.0 109.336 178.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 19.5 m -145.81 150.19 35.73 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.759 1.224 . . . . 0.0 109.114 169.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.33 138.09 54.63 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 127.369 2.268 . . . . 0.0 108.569 -178.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.0 t -134.72 136.58 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.032 0.933 . . . . 0.0 111.322 -169.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.53 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 36.9 t -120.73 149.6 42.27 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.023 1.729 . . . . 0.0 111.337 177.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.3 p -130.06 0.77 4.73 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.432 1.493 . . . . 0.0 114.276 -177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 136.52 -11.43 4.04 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.456 1.027 . . . . 0.0 115.46 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 89.3 p -156.62 160.29 39.26 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 119.039 1.42 . . . . 0.0 114.022 -172.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 48.7 t-105 -57.39 137.72 81.34 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.832 1.653 . . . . 0.0 114.759 177.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -98.51 176.36 7.94 Favored 'Cis proline' 0 CA--C 1.549 1.232 0 CA-C-N 120.155 1.091 . . . . 0.0 111.376 -10.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.9 mp -71.35 165.13 24.38 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.168 -0.957 . . . . 0.0 110.823 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -120.33 135.48 55.0 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.15 1.38 . . . . 0.0 111.663 -176.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -88.49 149.91 23.4 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.173 1.389 . . . . 0.0 112.054 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.1 t -153.59 170.42 20.86 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.386 1.874 . . . . 0.0 110.66 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.8 mp -101.43 136.77 40.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.111 0.964 . . . . 0.0 108.83 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 35.94 54.82 0.96 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.339 1.856 . . . . 0.0 114.81 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 51.2 ptt85 43.52 33.82 0.7 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.106 2.563 . . . . 0.0 117.015 -177.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.28 -31.5 67.53 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 59.7 p -79.7 -5.18 54.67 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 172.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -137.4 75.76 44.79 Favored Pre-proline 0 N--CA 1.476 0.833 0 C-N-CA 125.614 1.566 . . . . 0.0 112.311 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo . . . . . 0 C--O 1.25 1.115 0 C-N-CA 124.661 3.574 . . . . 0.0 114.293 169.628 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.37 -48.93 65.29 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.934 1.694 . . . . 0.0 113.804 171.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.4 t -73.72 -45.84 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-O 118.6 -0.714 . . . . 0.0 109.948 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.21 -44.38 83.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.607 1.094 . . . . 0.0 112.673 -178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -62.49 -44.25 96.83 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.082 -1.011 . . . . 0.0 111.93 174.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.53 -50.5 72.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.012 0.525 . . . . 0.0 111.111 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -62.54 -37.44 86.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.193 0.997 . . . . 0.0 112.61 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.01 -46.47 89.37 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.128 0.876 . . . . 0.0 111.333 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.74 -37.41 82.12 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.487 1.115 . . . . 0.0 111.885 -178.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -66.08 -46.9 76.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.427 0.691 . . . . 0.0 112.442 171.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 62.7 m -63.07 -35.72 81.18 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.364 1.065 . . . . 0.0 111.281 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.53 79.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.128 1.371 . . . . 0.0 113.685 172.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.83 99.3 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.349 -0.844 . . . . 0.0 111.44 172.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -63.24 -42.55 99.23 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.583 0.753 . . . . 0.0 112.326 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -60.84 -42.31 97.52 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.888 0.767 . . . . 0.0 112.397 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.0 m -60.61 -44.2 96.56 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.419 0.688 . . . . 0.0 110.723 176.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.93 -1.106 . . . . 0.0 113.418 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.61 78.8 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.179 -0.951 . . . . 0.0 112.927 175.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.6 tp -71.3 -34.68 70.83 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.701 1.2 . . . . 0.0 112.038 172.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.1 -44.36 95.92 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.911 -1.118 . . . . 0.0 111.581 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.5 -44.7 62.59 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.438 1.495 . . . . 0.0 111.592 169.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.68 -42.99 97.97 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.46 -44.45 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 119.146 0.884 . . . . 0.0 110.758 175.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.21 -14.94 29.25 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.979 1.312 . . . . 0.0 113.795 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -112.09 -25.66 9.23 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 176.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.2 -29.6 69.92 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.062 1.301 . . . . 0.0 112.748 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -68.52 -19.15 64.5 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 173.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 pp -117.45 -24.67 7.26 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -169.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.8 m -86.22 -12.92 48.39 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.81 1.82 89.83 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.185 0.834 . . . . 0.0 115.185 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -146.8 148.76 34.15 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 127.733 2.413 . . . . 0.0 107.424 171.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -44.96 147.58 1.91 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.078 2.519 . . . . 0.0 112.868 168.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.8 t -104.48 165.23 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 126.144 1.778 . . . . 0.0 108.411 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.28 176.25 30.62 Favored Glycine 0 CA--C 1.522 0.483 0 O-C-N 120.629 -1.295 . . . . 0.0 115.479 -177.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.4 mt -133.81 121.04 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 125.145 1.378 . . . . 0.0 108.256 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -86.29 148.39 25.64 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.791 1.236 . . . . 0.0 110.482 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -134.84 149.0 50.28 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.88 1.672 . . . . 0.0 112.682 -176.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.6 t -146.0 -179.02 6.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.619 2.368 . . . . 0.0 110.105 177.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -58.22 -30.42 66.47 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 -169.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.8 m -138.48 4.54 2.4 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.823 1.249 . . . . 0.0 113.801 -179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.22 168.72 24.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.072 -1.017 . . . . 0.0 112.959 -173.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 17.8 p90 -157.06 161.85 39.48 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.737 2.015 . . . . 0.0 109.397 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 47.1 ttm-85 -155.04 145.95 22.54 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.103 1.361 . . . . 0.0 110.755 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.1 mm -64.17 146.24 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.48 1.112 . . . . 0.0 110.746 171.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 93.9 mtp -135.19 150.85 50.2 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.884 1.674 . . . . 0.0 110.701 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.7 m -142.16 161.81 48.76 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 125.82 1.648 . . . . 0.0 111.387 -170.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.03 -13.11 25.77 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.023 3.148 . . . . 0.0 116.926 -178.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 35.41 -96.83 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 C-N-CA 127.28 2.371 . . . . 0.0 116.287 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 mmmt -68.15 -29.01 67.81 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -168.57 123.4 0.76 Allowed Pre-proline 0 N--CA 1.477 0.88 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -77.15 -20.76 12.57 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.529 2.819 . . . . 0.0 112.25 169.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 t -76.25 -28.79 57.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.749 1.219 . . . . 0.0 112.796 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -130.99 17.23 5.1 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.9 t-105 60.82 76.51 0.37 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.726 2.01 . . . . 0.0 113.425 169.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.94 59.67 1.67 Allowed 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.928 -1.107 . . . . 0.0 112.667 -177.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -44.49 149.4 0.39 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.503 1.921 . . . . 0.0 115.509 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.0 m -142.02 157.15 64.59 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 126.125 1.77 . . . . 0.0 111.163 170.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.56 129.05 21.45 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.815 2.343 . . . . 0.0 109.967 169.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 57.4 tp -74.63 113.11 11.51 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.82 -0.55 . . . . 0.0 109.896 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -138.22 2.5 2.31 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.079 0.952 . . . . 0.0 112.628 169.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.75 -31.2 25.68 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.605 1.962 . . . . 0.0 115.616 -169.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -136.02 26.54 3.27 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.128 1.371 . . . . 0.0 112.029 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -130.27 -12.9 3.99 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.359 1.464 . . . . 0.0 113.222 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.03 -52.92 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 129.717 3.207 . . . . 0.0 114.846 -170.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -152.11 -14.21 0.18 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.723 2.409 . . . . 0.0 113.636 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.94 -1.25 3.8 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.276 -1.515 . . . . 0.0 114.19 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 97.2 p -67.93 -16.33 64.02 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.732 1.613 . . . . 0.0 114.133 170.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -84.49 -173.31 4.65 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -68.75 -119.4 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 125.493 1.517 . . . . 0.0 114.345 175.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.8 t70 60.6 16.78 6.83 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 125.758 1.623 . . . . 0.0 112.623 -167.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 30.8 m0 -77.1 -15.1 59.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.774 1.63 . . . . 0.0 113.348 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -141.32 166.64 24.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.538 1.535 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.68 -33.21 0.26 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.688 2.395 . . . . 0.0 112.116 -176.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -87.92 1.4 54.16 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.028 1.331 . . . . 0.0 113.336 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.9 mt -120.55 166.47 13.58 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 122.979 1.371 . . . . 0.0 114.635 -170.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.5 t -145.13 139.98 27.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 129.244 3.018 . . . . 0.0 106.892 169.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -117.43 146.6 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.163 0.985 . . . . 0.0 111.262 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -139.07 157.34 46.15 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.186 1.794 . . . . 0.0 109.88 175.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.24 170.54 18.73 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 172.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -160.31 161.8 24.86 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 127.819 2.447 . . . . 0.0 109.972 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.86 -15.89 5.48 Favored 'Cis proline' 0 CA--C 1.54 0.775 0 CA-C-N 121.442 1.551 . . . . 0.0 115.65 -10.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -65.43 -176.06 0.3 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.054 1.342 . . . . 0.0 112.692 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.09 147.2 57.73 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.151 0.98 . . . . 0.0 113.071 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -76.13 90.74 1.15 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.941 3.094 . . . . 0.0 110.891 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -155.42 162.31 40.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.222 1.409 . . . . 0.0 111.478 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -74.19 54.42 0.55 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.816 2.047 . . . . 0.0 114.076 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.2 m -58.65 157.01 9.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.308 1.443 . . . . 0.0 113.509 177.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -75.17 2.16 11.55 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -149.61 163.35 25.25 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 127.201 2.2 . . . . 0.0 109.652 179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -65.66 143.13 73.44 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 121.268 1.312 . . . . 0.0 109.564 168.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -73.97 -47.39 37.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.704 -0.622 . . . . 0.0 111.287 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.9 t -83.29 135.17 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.254 1.022 . . . . 0.0 109.314 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 93.8 t -134.98 144.73 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 123.777 0.831 . . . . 0.0 111.15 -178.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.01 118.89 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.034 2.534 . . . . 0.0 109.411 -169.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.6 mt -78.61 161.51 26.92 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.081 0.943 . . . . 0.0 111.692 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.48 -27.39 66.08 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.005 1.322 . . . . 0.0 113.976 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -85.85 -8.14 58.27 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.091 1.756 . . . . 0.0 113.528 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.31 7.45 60.68 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.261 0.934 . . . . 0.0 114.669 -176.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -74.19 138.54 43.83 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.546 1.173 . . . . 0.0 108.502 169.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.1 mm -129.2 150.54 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.008 1.323 . . . . 0.0 109.235 -171.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.0 p -49.22 120.71 10.26 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 124.336 1.054 . . . . 0.0 111.778 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.16 84.44 1.51 Allowed 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.445 2.763 . . . . 0.0 111.71 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -122.01 -179.52 4.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.218 1.807 . . . . 0.0 111.878 -178.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 m -142.29 144.51 33.3 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.142 -0.974 . . . . 0.0 112.165 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.87 144.84 48.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 128.815 2.846 . . . . 0.0 108.78 -175.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -135.6 146.75 48.25 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.373 1.469 . . . . 0.0 110.688 -178.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 56.3 mtt -123.55 131.58 53.67 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 110.005 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.79 145.3 50.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.23 1.812 . . . . 0.0 110.932 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -52.99 129.75 31.57 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.531 1.132 . . . . 0.0 110.302 172.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.4 -18.32 17.17 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.377 1.992 . . . . 0.0 116.377 -174.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.4 -37.89 0.47 Allowed Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.749 -1.028 . . . . 0.0 115.222 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 48.5 p -77.72 -26.05 49.77 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.793 1.796 . . . . 0.0 112.523 171.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.24 5.19 75.98 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.78 1.181 . . . . 0.0 114.104 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.66 124.34 90.65 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.002 1.321 . . . . 0.0 111.451 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.31 142.96 78.17 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.328 2.685 . . . . 0.0 113.292 170.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.69 -35.05 4.04 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.088 0.955 . . . . 0.0 111.555 172.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.8 tp -151.47 153.78 35.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.539 1.136 . . . . 0.0 111.055 -169.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.9 m -142.79 144.72 32.7 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 125.739 1.615 . . . . 0.0 108.814 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.3 mp -124.01 137.57 54.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.599 1.96 . . . . 0.0 108.759 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.2 t -134.49 138.39 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.124 0.97 . . . . 0.0 111.113 -169.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.8 t -116.18 117.61 30.53 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.494 1.118 . . . . 0.0 111.552 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -76.31 -8.13 56.45 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 122.19 0.94 10.46 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.481 1.515 . . . . 0.0 114.376 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 82.5 p -156.92 159.39 38.06 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.174 -1.192 . . . . 0.0 113.412 -173.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -62.51 138.43 96.54 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.997 1.719 . . . . 0.0 115.074 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -94.84 174.55 13.49 Favored 'Cis proline' 0 CA--C 1.546 1.097 0 CA-C-N 119.947 1.017 . . . . 0.0 110.812 -11.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.96 153.75 43.06 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 122.269 1.033 . . . . 0.0 110.889 169.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -100.99 116.1 32.04 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.694 1.598 . . . . 0.0 110.752 -177.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.22 145.42 37.6 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.401 1.081 . . . . 0.0 111.291 176.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.8 t -147.47 148.3 31.1 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.957 1.703 . . . . 0.0 110.588 169.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -72.19 132.59 44.33 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.46 -0.775 . . . . 0.0 109.434 170.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.01 66.02 0.06 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.294 2.237 . . . . 0.0 115.836 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 32.7 mtm105 56.34 21.89 5.84 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.31 -27.39 67.28 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.978 1.717 . . . . 0.0 114.791 -177.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 69.4 p -101.52 7.2 42.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.817 1.247 . . . . 0.0 113.792 169.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 19.1 tpt85 -136.59 45.19 1.16 Allowed Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 126.362 1.865 . . . . 0.0 112.971 -173.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo . . . . . 0 C--O 1.251 1.155 0 C-N-CA 124.031 3.154 . . . . 0.0 114.068 -173.505 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.9 mmm . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 120.327 0.108 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.02 163.54 37.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.322 1.449 . . . . 0.0 111.608 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -75.31 -16.76 60.39 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 69.09 25.72 75.21 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 123.965 0.793 . . . . 0.0 114.512 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.82 32.23 2.22 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.647 1.979 . . . . 0.0 111.555 -171.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -97.65 -27.19 14.48 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -169.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.51 -39.95 81.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.052 1.296 . . . . 0.0 114.493 -169.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.0 t -65.6 -49.2 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.869 0.868 . . . . 0.0 110.492 177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.13 -38.73 88.88 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.572 0.749 . . . . 0.0 112.418 177.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -62.25 -41.77 98.73 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.095 0.958 . . . . 0.0 111.224 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.5 m -63.48 -48.24 78.48 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.799 -0.563 . . . . 0.0 111.619 173.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.5 mmt-85 -61.69 -32.15 72.33 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.403 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.92 76.75 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.675 1.58 . . . . 0.0 111.848 173.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.0 mtm105 -62.2 -41.15 98.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.641 0.776 . . . . 0.0 111.73 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.11 -49.4 77.45 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -35.66 76.31 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.215 1.006 . . . . 0.0 111.484 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.18 88.11 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 172.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.57 97.82 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.084 0.856 . . . . 0.0 111.86 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.0 mtt85 -62.19 -45.57 92.78 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.63 1.172 . . . . 0.0 111.707 176.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -60.78 -44.28 97.0 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.623 0.769 . . . . 0.0 112.653 172.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.8 m -60.55 -43.42 97.24 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.912 0.778 . . . . 0.0 110.78 178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.83 97.07 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.975 -1.078 . . . . 0.0 113.276 172.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -32.18 73.66 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.275 -0.89 . . . . 0.0 113.115 175.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.3 tp -73.56 -33.72 64.82 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.204 1.401 . . . . 0.0 111.786 172.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -62.82 -45.33 93.13 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.892 -1.13 . . . . 0.0 110.704 169.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 tp -52.2 -46.39 65.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.439 1.496 . . . . 0.0 111.324 169.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.64 96.92 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.0 mt -62.81 -45.42 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.708 0.803 . . . . 0.0 110.689 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.06 -35.74 79.56 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.675 0.79 . . . . 0.0 112.815 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -74.94 -32.46 61.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.338 1.055 . . . . 0.0 113.164 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.14 -37.88 88.97 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -177.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -70.01 -28.55 65.59 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 121.527 -0.733 . . . . 0.0 112.504 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.3 mt -80.72 -31.99 35.91 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.081 1.352 . . . . 0.0 112.971 178.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.4 m -82.21 -20.23 38.17 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -170.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.75 3.4 79.46 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.313 0.885 . . . . 0.0 115.313 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -143.03 149.12 47.99 Favored Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.127 2.571 . . . . 0.0 107.175 172.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -45.54 143.51 5.89 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 122.647 2.231 . . . . 0.0 111.807 168.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 25.6 t -88.14 162.5 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.587 1.155 . . . . 0.0 108.716 173.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.93 176.63 23.13 Favored Glycine 0 N--CA 1.46 0.282 0 O-C-N 121.261 -0.9 . . . . 0.0 113.567 173.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.5 mt -137.3 117.18 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.672 1.189 . . . . 0.0 108.813 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -74.77 146.87 41.77 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.239 1.816 . . . . 0.0 110.473 170.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -145.17 133.99 22.36 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.403 1.481 . . . . 0.0 110.351 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -150.74 27.17 0.72 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.057 1.343 . . . . 0.0 113.442 -173.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.8 t0 63.08 -66.97 0.09 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 128.242 2.617 . . . . 0.0 113.867 -176.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 75.2 m -66.54 -24.34 66.36 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.909 0.884 . . . . 0.0 113.162 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.05 169.79 21.5 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.559 1.144 . . . . 0.0 112.048 174.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.5 p90 -153.98 164.41 38.47 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 128.596 2.758 . . . . 0.0 107.469 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -167.09 146.8 5.37 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.615 1.098 . . . . 0.0 112.713 172.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.3 mm -66.29 152.89 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.473 0.709 . . . . 0.0 109.175 170.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.1 mtp -142.94 151.29 40.79 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.635 1.574 . . . . 0.0 111.96 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.0 m -141.66 164.0 37.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.432 1.893 . . . . 0.0 111.521 -169.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -63.15 167.7 12.1 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.753 2.302 . . . . 0.0 113.47 171.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -156.98 163.27 32.21 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.888 1.709 . . . . 0.0 110.67 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 tptm 59.05 -44.46 0.07 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 128.303 2.641 . . . . 0.0 115.885 -169.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.8 t -155.08 141.63 13.26 Favored Pre-proline 0 N--CA 1.472 0.656 0 C-N-CA 125.794 1.637 . . . . 0.0 111.797 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_endo -79.8 -16.93 11.26 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 C-N-CA 123.188 2.592 . . . . 0.0 112.442 169.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.8 m -77.66 -7.03 55.83 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -169.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.38 151.62 36.81 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.014 1.325 . . . . 0.0 111.48 178.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.3 t-105 -52.69 112.02 0.76 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.946 1.699 . . . . 0.0 112.452 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -152.78 157.42 40.77 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.518 1.527 . . . . 0.0 110.221 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -143.15 143.7 31.91 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -174.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -145.41 139.71 15.21 Favored Pre-proline 0 N--CA 1.472 0.639 0 C-N-CA 128.73 2.812 . . . . 0.0 107.717 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -66.45 130.83 24.67 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.521 2.147 . . . . 0.0 111.635 174.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -79.3 78.08 5.8 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.796 0.839 . . . . 0.0 110.914 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -136.08 25.98 3.27 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.375 1.47 . . . . 0.0 112.133 174.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -58.71 -25.04 62.49 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 171.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -149.95 -26.8 0.25 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.108 1.363 . . . . 0.0 113.779 169.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.95 24.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 125.411 1.484 . . . . 0.0 114.193 169.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.36 121.15 8.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.562 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 55.13 22.84 4.84 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -173.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -119.32 -30.71 4.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.484 1.514 . . . . 0.0 110.686 169.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.9 t -67.9 -21.14 65.16 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.979 1.712 . . . . 0.0 112.308 169.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -137.4 152.79 50.01 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.217 1.407 . . . . 0.0 114.54 -169.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 46.95 -34.58 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.179 1 C-N-CA 131.974 4.11 . . . . 0.0 120.882 169.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.76 -15.62 63.02 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -169.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -68.43 -15.07 63.42 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -146.53 171.09 15.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.374 1.07 . . . . 0.0 113.696 -176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -142.9 17.87 1.96 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.746 1.618 . . . . 0.0 112.582 172.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -144.53 0.59 1.01 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -168.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 58.8 mt -121.88 161.27 23.1 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -168.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.3 m -130.61 136.26 48.68 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.991 2.916 . . . . 0.0 106.685 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.93 141.53 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 125.01 1.324 . . . . 0.0 110.516 -169.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -139.08 153.42 48.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.52 1.528 . . . . 0.0 109.29 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.57 171.07 16.72 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 172.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.33 154.97 28.3 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 127.634 2.374 . . . . 0.0 109.707 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.94 -10.93 27.07 Favored 'Cis proline' 0 CA--C 1.542 0.924 0 CA-C-N 121.368 1.524 . . . . 0.0 114.633 0.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -67.84 -171.43 0.21 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.27 1.428 . . . . 0.0 110.988 169.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.3 147.44 43.56 Favored Pre-proline 0 N--CA 1.479 0.976 0 O-C-N 120.787 -1.195 . . . . 0.0 112.82 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.1 105.23 1.15 Allowed 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.12 2.546 . . . . 0.0 109.543 174.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -160.98 137.87 8.81 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.885 1.274 . . . . 0.0 111.306 -169.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -69.78 46.6 0.07 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.355 2.662 . . . . 0.0 114.313 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.3 t -63.25 158.97 18.82 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.37 1.868 . . . . 0.0 114.159 -176.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -71.25 -5.09 29.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.974 1.31 . . . . 0.0 113.41 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -131.11 164.2 43.89 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 125.794 1.638 . . . . 0.0 111.321 176.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.02 162.12 36.78 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 122.45 2.1 . . . . 0.0 112.472 169.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -99.12 -12.22 20.7 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.12 1.368 . . . . 0.0 112.78 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.3 t -132.26 148.81 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 126.206 1.802 . . . . 0.0 109.398 172.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 73.0 t -135.49 143.09 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.77 1.228 . . . . 0.0 111.392 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -129.45 126.58 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 128.795 2.838 . . . . 0.0 109.91 -169.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.0 mt -83.98 159.81 21.16 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.123 0.963 . . . . 0.0 112.092 174.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.87 -26.58 67.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.2 1.4 . . . . 0.0 113.939 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -82.3 -8.6 59.64 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.651 1.58 . . . . 0.0 113.335 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.63 5.72 62.92 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 124.506 1.051 . . . . 0.0 114.735 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -72.01 138.83 48.23 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.507 1.154 . . . . 0.0 108.962 169.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 6.9 mm -128.05 132.9 68.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 124.558 1.143 . . . . 0.0 109.422 -171.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.3 m -61.02 118.63 37.62 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.261 1.424 . . . . 0.0 110.431 178.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -52.07 132.7 44.16 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 124.017 3.144 . . . . 0.0 115.294 -176.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.432 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 8.7 p90 -162.72 174.66 12.22 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.525 1.93 . . . . 0.0 111.667 175.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.6 m -137.01 139.95 41.77 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.622 1.169 . . . . 0.0 109.463 169.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.2 tp -131.66 122.42 25.95 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.857 2.063 . . . . 0.0 109.01 -169.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.4 tt -118.78 144.58 46.2 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.265 1.826 . . . . 0.0 110.995 -169.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.1 mtt -123.54 128.3 49.55 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.093 1.357 . . . . 0.0 110.868 -176.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.16 139.13 54.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.071 1.349 . . . . 0.0 111.458 -178.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.516 ' HB2' HD11 ' A' ' 121' ' ' LEU . 42.5 t-20 -64.18 113.57 3.64 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.795 1.638 . . . . 0.0 110.893 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.59 -18.02 50.2 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -87.17 -17.23 59.49 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.721 1.153 . . . . 0.0 114.825 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.8 p -135.97 -28.74 1.05 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.171 1.485 . . . . 0.0 114.159 -169.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 89.64 -3.34 83.34 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.818 1.675 . . . . 0.0 113.885 -173.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -79.17 137.22 56.69 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 118.831 1.316 . . . . 0.0 112.496 -176.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.96 142.4 42.55 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.898 2.399 . . . . 0.0 111.685 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 114' ' ' ASN . 0.2 OUTLIER -113.88 -35.18 5.2 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.717 0.807 . . . . 0.0 112.266 177.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.429 HD21 HE21 ' A' ' 134' ' ' GLN . 6.3 tp -155.74 151.55 27.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.257 1.023 . . . . 0.0 111.178 -168.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 75.6 m -139.83 152.83 46.83 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.506 1.122 . . . . 0.0 109.172 169.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.6 mt -124.66 142.53 51.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.681 2.392 . . . . 0.0 108.351 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 34.1 t -135.2 136.24 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.73 0.812 . . . . 0.0 111.969 -169.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.432 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.1 t -124.67 135.13 52.79 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.266 1.826 . . . . 0.0 110.919 -179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.1 m -131.09 7.65 4.67 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.384 1.074 . . . . 0.0 113.824 -176.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 144.73 -18.31 2.01 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.389 1.316 . . . . 0.0 116.389 172.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.3 t -157.36 155.79 31.2 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.786 1.793 . . . . 0.0 113.623 -172.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -58.59 141.8 83.75 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 115.589 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -93.18 178.34 11.88 Favored 'Cis proline' 0 CA--C 1.547 1.173 0 CA-C-N 119.757 0.949 . . . . 0.0 110.769 -11.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.89 155.77 38.65 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.107 -0.996 . . . . 0.0 111.801 169.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -98.07 119.81 37.36 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.231 1.412 . . . . 0.0 110.867 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.429 HE21 HD21 ' A' ' 122' ' ' LEU . 53.2 tt0 -81.98 143.26 31.73 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.57 1.548 . . . . 0.0 111.323 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 3.4 t -142.75 145.01 32.87 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.013 1.325 . . . . 0.0 111.306 175.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.58 137.06 49.73 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 169.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 40.36 -97.98 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.125 1.77 . . . . 0.0 113.314 -169.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -135.35 22.18 3.43 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.524 1.53 . . . . 0.0 112.235 178.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.01 -21.44 21.4 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -169.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 1.2 t -120.8 11.97 11.24 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 73.91 71.34 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 125.117 1.367 . . . . 0.0 111.628 -170.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 C--O 1.251 1.132 0 C-N-CA 124.738 3.625 . . . . 0.0 114.685 175.358 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 tpt . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.545 0.212 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.05 175.09 1.31 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.949 1.299 . . . . 0.0 113.863 175.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -61.29 -22.48 64.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.699 1.2 . . . . 0.0 114.189 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.79 -38.39 0.02 OUTLIER Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.186 0.898 . . . . 0.0 114.497 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -152.31 152.84 32.62 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.097 1.359 . . . . 0.0 110.974 176.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.26 -36.6 0.65 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.408 1.883 . . . . 0.0 113.342 -175.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -60.34 -38.75 84.78 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.316 0.962 . . . . 0.0 113.146 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -63.86 -46.21 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.875 0.87 . . . . 0.0 110.679 173.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -41.75 97.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.36 0.527 . . . . 0.0 112.231 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -63.3 -44.98 93.45 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.398 0.999 . . . . 0.0 111.913 173.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -58.42 -53.04 62.81 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.308 0.643 . . . . 0.0 110.807 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.4 mmp_? -62.0 -32.96 73.48 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.299 1.039 . . . . 0.0 113.049 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.69 -50.98 69.0 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.186 1.357 . . . . 0.0 111.42 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -67.06 -36.06 81.2 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.803 -0.561 . . . . 0.0 111.455 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -63.48 -44.69 93.69 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 169.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.4 m -58.22 -41.17 83.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.361 -0.837 . . . . 0.0 111.075 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.91 -40.48 91.51 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.26 97.63 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.349 0.977 . . . . 0.0 111.954 173.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -62.63 -44.09 97.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.932 1.293 . . . . 0.0 111.405 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -59.27 -44.82 92.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.489 0.715 . . . . 0.0 112.417 170.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -61.34 -43.12 99.41 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.079 0.854 . . . . 0.0 111.037 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.04 99.57 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 120.784 -1.197 . . . . 0.0 113.082 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.82 -32.4 73.66 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 121.317 -0.864 . . . . 0.0 113.116 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 35.3 tp -71.13 -31.98 68.42 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.667 1.587 . . . . 0.0 111.783 172.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.3 -44.93 93.62 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.985 -1.072 . . . . 0.0 111.135 169.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -52.88 -46.13 67.79 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.097 1.359 . . . . 0.0 111.417 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.33 96.86 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 176.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.3 mt -62.72 -45.61 98.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.241 1.016 . . . . 0.0 111.016 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -60.18 -34.48 73.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.76 0.824 . . . . 0.0 112.665 177.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -80.82 -36.07 32.09 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.98 -31.18 68.53 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.63 -11.25 60.36 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 74.5 mt -114.19 -31.6 6.27 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.363 1.865 . . . . 0.0 113.42 -173.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.8 p -72.88 -20.87 61.02 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.045 1.738 . . . . 0.0 115.563 -172.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.23 -20.32 30.51 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.637 1.113 . . . . 0.0 114.313 176.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -128.38 147.02 62.08 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 127.861 2.465 . . . . 0.0 106.925 169.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -42.26 154.04 0.12 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.86 3.04 . . . . 0.0 114.511 169.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -105.6 162.24 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 126.119 1.768 . . . . 0.0 108.657 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.49 178.37 33.86 Favored Glycine 0 N--CA 1.468 0.828 0 CA-C-N 120.752 1.615 . . . . 0.0 115.35 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.9 mp -131.6 124.11 53.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.737 1.215 . . . . 0.0 110.178 177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -79.39 139.87 37.61 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 126.599 1.96 . . . . 0.0 109.433 169.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -138.39 134.53 34.26 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 125.406 1.482 . . . . 0.0 108.872 -177.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.1 t -142.76 -175.67 4.58 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.946 1.298 . . . . 0.0 111.843 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -55.69 -26.96 47.64 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -169.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.84 -5.37 1.33 Allowed 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.52 175.66 13.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.621 1.168 . . . . 0.0 112.317 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 32.4 p90 -151.8 157.95 42.63 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.451 1.901 . . . . 0.0 110.138 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.5 ttp180 -159.26 134.15 8.1 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.804 1.242 . . . . 0.0 112.39 -173.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.2 mt -68.21 147.01 12.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 123.811 0.844 . . . . 0.0 110.114 176.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 84.4 mtp -135.99 154.46 51.07 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.942 1.697 . . . . 0.0 111.249 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 m -146.85 165.23 20.02 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 126.16 1.784 . . . . 0.0 111.256 -170.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -62.93 159.14 39.53 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.168 1.912 . . . . 0.0 111.184 169.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -152.87 -62.16 0.01 OUTLIER Glycine 0 N--CA 1.475 1.235 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -65.63 -29.43 70.01 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.313 1.056 . . . . 0.0 113.625 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 t -154.1 137.64 10.54 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 125.102 1.361 . . . . 0.0 110.375 169.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -80.75 2.62 8.41 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.127 3.218 . . . . 0.0 113.193 170.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.0 m -122.43 -2.25 9.0 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -169.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -148.01 153.52 39.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.205 1.002 . . . . 0.0 111.914 173.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.8 t-105 -53.14 105.56 0.13 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.858 1.663 . . . . 0.0 114.331 -171.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.515 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.8 tpm_? -156.05 159.01 38.75 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.999 1.72 . . . . 0.0 110.207 169.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.515 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 96.6 m95 -140.04 139.32 35.93 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.265 1.426 . . . . 0.0 112.093 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.51 154.87 73.79 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 126.907 2.083 . . . . 0.0 109.411 171.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.47 136.27 36.15 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 122.531 2.154 . . . . 0.0 112.616 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.72 -16.95 64.25 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.842 1.257 . . . . 0.0 112.869 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -48.36 -18.94 0.26 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.319 1.848 . . . . 0.0 113.438 168.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -50.75 -28.62 9.57 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.796 1.239 . . . . 0.0 113.883 169.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -139.71 0.26 1.8 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 117.119 2.266 . . . . 0.0 117.119 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.39 57.57 1.8 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.706 1.203 . . . . 0.0 109.515 169.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.68 -27.27 0.47 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 118.266 2.691 . . . . 0.0 118.266 -169.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -129.73 2.89 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 114.576 1.324 . . . . 0.0 114.576 -174.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -127.11 -13.06 5.73 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.533 1.133 . . . . 0.0 113.634 -178.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 52.1 p -73.66 -10.72 59.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.93 1.292 . . . . 0.0 114.411 172.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -121.18 177.25 5.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.031 1.732 . . . . 0.0 111.482 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -54.17 126.29 22.35 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.04 0.924 . . . . 0.0 112.954 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -157.49 29.94 0.28 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 128.993 2.917 . . . . 0.0 107.41 169.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -112.83 -9.32 13.67 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -167.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.39 170.21 16.42 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.391 1.076 . . . . 0.0 113.552 -175.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -138.92 2.46 2.15 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.71 1.204 . . . . 0.0 114.246 173.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -156.47 17.02 0.33 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.131 0.972 . . . . 0.0 113.444 -169.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -122.52 157.16 32.64 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.345 -1.472 . . . . 0.0 113.086 -169.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.8 t -135.82 142.85 44.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.854 2.062 . . . . 0.0 109.063 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.99 147.18 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.597 1.159 . . . . 0.0 111.14 -169.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -137.22 162.47 33.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.092 1.757 . . . . 0.0 110.264 173.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 73.6 mt -127.91 158.73 37.02 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -150.14 139.93 13.56 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 125.684 1.594 . . . . 0.0 109.227 169.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -76.4 -7.59 27.93 Favored 'Cis proline' 0 CA--C 1.545 1.043 0 CA-C-N 121.537 1.585 . . . . 0.0 113.399 -8.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -62.96 177.94 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.262 1.425 . . . . 0.0 112.167 169.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -135.78 146.68 58.1 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.6 1.16 . . . . 0.0 113.352 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -81.57 107.05 1.75 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.439 2.759 . . . . 0.0 110.115 169.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -157.77 160.01 37.39 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.087 0.955 . . . . 0.0 112.342 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.99 38.43 0.11 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 127.468 2.307 . . . . 0.0 114.02 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.8 m -59.4 156.62 12.56 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.008 1.723 . . . . 0.0 114.353 -175.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -69.6 -0.98 7.63 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.402 1.481 . . . . 0.0 114.629 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -143.58 165.19 26.28 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 127.448 2.299 . . . . 0.0 110.278 -176.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.72 155.82 64.95 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.172 1.915 . . . . 0.0 111.965 169.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -91.24 -14.95 30.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.663 1.185 . . . . 0.0 112.493 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.3 t -132.46 139.22 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 126.103 1.761 . . . . 0.0 109.078 177.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 83.1 t -133.09 147.53 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 119.443 1.02 . . . . 0.0 112.227 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -126.86 116.43 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 128.66 2.784 . . . . 0.0 108.942 -169.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -70.83 160.32 32.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.209 1.804 . . . . 0.0 111.981 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.97 -7.05 10.03 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 -177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -121.67 10.67 10.38 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 0.0 112.992 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 91.95 7.86 63.91 Favored Glycine 0 CA--C 1.535 1.331 0 N-CA-C 115.963 1.145 . . . . 0.0 115.963 173.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -75.65 150.95 37.84 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.947 1.373 . . . . 0.0 107.801 169.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.5 mm -130.41 143.61 40.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 124.531 1.132 . . . . 0.0 108.939 -172.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 p -52.05 118.89 13.01 Favored Pre-proline 0 N--CA 1.473 0.699 0 CA-C-O 117.43 -1.271 . . . . 0.0 111.1 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.78 115.06 2.08 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.016 2.477 . . . . 0.0 112.811 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.514 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.8 p90 -155.03 179.14 9.43 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.006 1.323 . . . . 0.0 112.908 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.9 p -143.24 152.91 42.25 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 125.331 1.452 . . . . 0.0 110.883 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.45 119.21 17.2 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 127.265 2.226 . . . . 0.0 108.806 -169.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.2 tt -110.94 145.86 37.62 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.349 1.46 . . . . 0.0 110.353 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 42.9 mtt -127.29 129.99 48.71 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.816 1.247 . . . . 0.0 110.355 -178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -129.99 141.71 50.72 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.528 1.531 . . . . 0.0 112.192 -171.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -61.05 109.92 1.22 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.321 1.849 . . . . 0.0 110.925 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -18.22 57.03 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -177.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.59 -16.47 68.38 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.314 0.959 . . . . 0.0 114.561 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.8 m -130.53 -27.53 2.15 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.706 1.253 . . . . 0.0 113.64 -169.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.83 36.86 40.77 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.1 0.857 . . . . 0.0 113.09 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -131.83 129.05 21.82 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.221 1.409 . . . . 0.0 111.071 -170.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.54 148.54 52.76 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.841 3.027 . . . . 0.0 114.914 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.12 -38.94 2.97 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.109 1.364 . . . . 0.0 110.973 169.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 39.9 tp -148.58 152.51 36.91 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 126.256 1.822 . . . . 0.0 110.151 -168.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.2 m -145.15 148.88 34.07 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 124.452 1.101 . . . . 0.0 108.931 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.6 mp -117.98 146.55 43.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 127.253 2.221 . . . . 0.0 108.405 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.23 141.67 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.122 0.969 . . . . 0.0 111.298 -174.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 21.9 t -120.38 121.25 38.15 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.94 1.696 . . . . 0.0 111.662 -176.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 61.7 p -74.94 -14.52 60.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.76 1.224 . . . . 0.0 114.004 170.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.33 2.77 4.02 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 125.786 1.66 . . . . 0.0 114.449 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.7 t -152.91 161.09 42.98 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.956 1.378 . . . . 0.0 113.136 -175.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -46.98 144.81 3.62 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 127.435 2.294 . . . . 0.0 113.774 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -107.87 17.25 6.93 Favored 'Cis proline' 0 CA--C 1.55 1.312 0 CA-C-N 120.744 1.301 . . . . 0.0 114.381 -2.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp 74.29 168.49 0.3 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 127.696 2.398 . . . . 0.0 112.405 -169.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -129.14 135.78 49.33 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.514 1.126 . . . . 0.0 111.558 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -82.68 155.77 24.18 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.725 1.21 . . . . 0.0 112.82 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 10.9 t -151.23 140.66 21.5 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.607 1.963 . . . . 0.0 109.976 169.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.61 130.63 43.63 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.389 -0.82 . . . . 0.0 109.383 169.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.07 63.2 0.27 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.376 1.871 . . . . 0.0 115.381 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 47.72 24.01 0.5 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 117.737 2.495 . . . . 0.0 117.737 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -57.67 -28.91 64.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -175.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.5 p -91.41 -8.15 48.7 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 175.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -63.95 -39.71 47.85 Favored Pre-proline 0 N--CA 1.478 0.975 0 CA-C-O 115.95 -1.976 . . . . 0.0 115.019 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo . . . . . 0 C--O 1.251 1.127 0 C-N-CA 124.09 3.194 . . . . 0.0 115.296 177.425 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 121.364 0.602 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.66 -172.18 0.34 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.859 1.664 . . . . 0.0 113.188 171.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -59.71 -7.84 1.77 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.077 1.751 . . . . 0.0 115.496 178.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -150.25 158.13 27.53 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 126.076 1.798 . . . . 0.0 111.076 170.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -64.19 71.66 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 127.655 2.382 . . . . 0.0 114.67 -169.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -50.16 -37.92 36.93 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.201 1.401 . . . . 0.0 112.822 171.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.46 -14.68 5.26 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.734 2.413 . . . . 0.0 114.761 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.2 t -118.13 -41.61 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.334 1.454 . . . . 0.0 110.514 170.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.39 79.28 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.301 0.955 . . . . 0.0 113.531 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.618 ' HA ' HD11 ' A' ' 121' ' ' LEU . 11.1 m120 -57.06 -34.93 68.75 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.188 0.904 . . . . 0.0 113.284 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.8 m -81.84 -49.85 9.89 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.183 0.993 . . . . 0.0 111.053 174.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -67.28 -26.67 66.66 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -172.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.415 ' CB ' HD12 ' A' ' 121' ' ' LEU . . . -63.9 -43.94 94.46 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.719 1.145 . . . . 0.0 111.812 169.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -67.19 -37.88 84.44 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.887 0.875 . . . . 0.0 110.922 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -63.06 -46.15 88.82 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.6 m -58.74 -40.91 85.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.934 0.893 . . . . 0.0 111.242 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.58 -41.34 92.98 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.573 1.149 . . . . 0.0 113.297 174.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.53 96.86 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.801 . . . . 0.0 112.056 173.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 64.7 mtt85 -62.75 -45.65 91.7 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.561 1.144 . . . . 0.0 111.553 175.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -57.95 -45.33 86.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.727 0.811 . . . . 0.0 112.559 170.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 64.6 m -62.01 -43.29 99.14 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.886 0.766 . . . . 0.0 111.02 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.16 96.65 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.869 -1.144 . . . . 0.0 112.968 172.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.56 -32.14 73.57 Favored 'General case' 0 CA--C 1.547 0.842 0 O-C-N 121.346 -0.846 . . . . 0.0 113.269 175.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 tp -72.51 -34.68 67.78 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.879 1.272 . . . . 0.0 111.74 172.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.42 -45.09 94.68 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.969 -1.082 . . . . 0.0 110.778 169.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.89 -46.54 64.57 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.325 1.45 . . . . 0.0 110.921 169.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.16 -39.54 94.97 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.62 -46.33 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.833 0.853 . . . . 0.0 110.784 174.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.08 -38.17 87.8 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.137 0.575 . . . . 0.0 112.525 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -68.18 -34.15 75.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.402 1.081 . . . . 0.0 112.281 175.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -24.67 64.15 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.9 t -83.46 -12.32 56.48 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.262 0.937 . . . . 0.0 112.884 173.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.88 -27.57 9.64 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.367 1.067 . . . . 0.0 113.559 -174.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.0 m -85.12 -20.74 29.84 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.59 0.59 89.28 Favored Glycine 0 CA--C 1.542 1.724 0 N-CA-C 115.233 0.853 . . . . 0.0 115.233 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -142.35 151.11 57.22 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 127.611 2.364 . . . . 0.0 107.168 169.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -47.05 157.46 0.58 Allowed 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.912 2.408 . . . . 0.0 113.0 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 78.2 t -120.02 158.99 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 125.173 1.389 . . . . 0.0 108.904 -173.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.39 174.51 30.55 Favored Glycine 0 CA--C 1.519 0.327 0 O-C-N 121.316 -0.865 . . . . 0.0 115.102 -177.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 52.9 mt -132.5 122.2 47.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 C-N-CA 124.774 1.23 . . . . 0.0 107.817 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -90.55 146.12 24.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.345 1.458 . . . . 0.0 110.579 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -140.88 131.71 25.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.977 1.711 . . . . 0.0 110.572 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 82.5 p -148.82 169.56 20.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.792 1.237 . . . . 0.0 112.495 175.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.14 -29.53 68.71 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 171.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 51.8 m -76.46 -49.88 15.48 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.262 1.025 . . . . 0.0 112.626 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -167.19 173.22 9.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.903 1.681 . . . . 0.0 112.1 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 38.5 p90 -127.62 147.43 50.36 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.328 1.451 . . . . 0.0 109.101 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.8 ptt-85 -155.62 147.54 23.32 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.31 1.044 . . . . 0.0 113.088 -169.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.5 mm -78.71 140.56 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.055 0.942 . . . . 0.0 109.209 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.7 mtp -136.17 148.53 48.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.164 0.986 . . . . 0.0 112.932 -177.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.6 m -143.79 169.67 9.92 Favored Pre-proline 0 N--CA 1.477 0.91 0 C-N-CA 127.709 2.404 . . . . 0.0 111.158 -169.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -54.81 -41.84 74.36 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 122.99 2.46 . . . . 0.0 114.312 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.87 -65.47 0.02 OUTLIER Glycine 0 CA--C 1.537 1.454 0 C-N-CA 127.624 2.535 . . . . 0.0 115.767 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -68.48 -54.63 15.66 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.28 1.432 . . . . 0.0 112.31 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.4 t -161.23 143.32 9.04 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 124.459 1.104 . . . . 0.0 112.296 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -79.93 -16.78 11.16 Favored 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 123.458 2.772 . . . . 0.0 112.789 169.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.8 m -73.92 -13.0 60.83 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -169.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -150.27 153.07 35.53 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.281 1.433 . . . . 0.0 111.031 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -58.24 113.18 1.82 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.859 1.264 . . . . 0.0 111.798 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.504 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 3.5 tpm_? -154.07 161.36 41.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.346 1.458 . . . . 0.0 110.174 174.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.504 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 92.7 m95 -139.8 139.64 36.45 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.991 1.316 . . . . 0.0 112.199 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.9 t -143.84 141.9 19.49 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 107.149 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -61.84 146.97 96.19 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 121.679 1.586 . . . . 0.0 111.065 170.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.4 tp -66.98 10.91 0.12 Allowed 'General case' 0 CA--C 1.555 1.155 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -61.85 -18.94 61.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.408 1.483 . . . . 0.0 112.729 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -62.05 -20.93 64.48 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.131 1.372 . . . . 0.0 113.987 171.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -146.27 -20.88 0.44 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 -175.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -111.41 11.86 21.5 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.493 1.117 . . . . 0.0 112.724 172.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.29 -169.25 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.181 2.192 . . . . 0.0 114.467 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -59.8 -11.11 4.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -68.37 -8.97 44.84 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.52 1.528 . . . . 0.0 113.763 170.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.0 m -63.64 8.87 0.07 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.609 1.964 . . . . 0.0 115.938 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -156.05 162.24 40.32 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.953 1.301 . . . . 0.0 114.113 -169.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.439 ' ND2' ' H ' ' A' ' 75' ' ' ASP . 7.2 t30 48.48 -158.36 0.06 Allowed 'General case' 0 CA--C 1.561 1.392 0 C-N-CA 126.902 2.081 . . . . 0.0 115.689 169.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.439 ' H ' ' ND2' ' A' ' 74' ' ' ASN . 1.0 OUTLIER 56.75 -6.76 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 120.669 3.581 . . . . 0.0 120.669 168.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -60.39 -21.13 61.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.853 1.661 . . . . 0.0 114.21 173.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -129.32 159.33 36.49 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.336 1.855 . . . . 0.0 112.244 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -141.88 18.53 2.14 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.37 1.068 . . . . 0.0 113.545 169.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -151.05 4.49 0.47 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.783 1.233 . . . . 0.0 113.993 -172.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -125.71 170.83 11.15 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.279 1.832 . . . . 0.0 111.5 -171.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 21.4 t -136.82 141.52 42.88 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.432 1.893 . . . . 0.0 109.123 169.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -115.64 145.6 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.348 1.459 . . . . 0.0 111.198 -169.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -141.05 152.31 44.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.197 1.799 . . . . 0.0 110.567 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.6 mt -118.96 144.8 46.27 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.211 1.004 . . . . 0.0 111.439 171.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -172.81 114.44 0.37 Allowed Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 127.217 2.207 . . . . 0.0 110.585 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.74 156.4 4.28 Favored 'Cis proline' 0 N--CA 1.452 -0.922 0 CA-C-N 121.363 1.523 . . . . 0.0 115.586 -10.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 79.31 -171.8 0.05 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 130.299 3.44 . . . . 0.0 110.947 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.65 148.41 43.03 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 124.183 0.993 . . . . 0.0 113.078 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.06 84.86 1.91 Allowed 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.787 2.991 . . . . 0.0 111.39 175.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -142.71 142.83 32.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.93 1.292 . . . . 0.0 111.148 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -71.74 66.06 0.52 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.537 1.535 . . . . 0.0 114.155 -173.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.5 t -67.15 156.64 35.7 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.603 1.961 . . . . 0.0 113.661 -178.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -69.25 -8.4 45.58 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.32 1.448 . . . . 0.0 113.451 171.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -136.49 163.61 48.61 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 126.204 1.801 . . . . 0.0 111.368 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -69.88 145.47 56.52 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 121.814 1.676 . . . . 0.0 110.477 168.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -74.01 -49.4 24.49 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.043 0.537 . . . . 0.0 110.957 171.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.4 t -89.8 135.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.962 1.305 . . . . 0.0 109.663 -177.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.2 t -132.89 145.6 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.906 0.882 . . . . 0.0 111.644 -176.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -127.81 136.33 60.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 128.445 2.698 . . . . 0.0 109.279 -169.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.6 mt -104.97 161.37 14.26 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.772 0.796 . . . . 0.0 112.074 170.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.44 -22.17 41.7 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 -170.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -103.59 5.13 36.38 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.952 1.301 . . . . 0.0 113.781 -177.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.51 8.74 57.19 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 115.552 0.981 . . . . 0.0 115.552 172.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -84.45 139.43 32.2 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.211 1.505 . . . . 0.0 108.161 169.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.9 mm -130.9 154.65 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 125.461 1.504 . . . . 0.0 109.858 -168.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.1 p -55.73 127.93 68.46 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.857 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.74 126.85 11.08 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 122.203 1.935 . . . . 0.0 111.047 173.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.531 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.5 p90 -160.38 -177.41 6.21 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.905 1.682 . . . . 0.0 112.069 -177.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.58 148.68 39.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.698 0.799 . . . . 0.0 111.165 170.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.0 tp -133.17 120.35 21.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 127.929 2.492 . . . . 0.0 108.257 -170.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.5 tt -115.32 146.14 41.81 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.525 1.13 . . . . 0.0 110.413 -174.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 48.4 mtt -128.3 140.43 51.88 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 125.404 1.481 . . . . 0.0 109.561 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.09 147.59 49.58 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.742 1.217 . . . . 0.0 111.481 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -61.41 122.39 15.06 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.312 1.045 . . . . 0.0 109.838 173.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.18 -21.31 64.99 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -171.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -96.64 -28.57 8.83 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-N 119.119 0.872 . . . . 0.0 114.219 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 79.6 p -93.01 -27.94 16.7 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.682 1.241 . . . . 0.0 112.969 176.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.96 7.93 72.01 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.695 1.14 . . . . 0.0 113.354 -169.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -89.36 135.23 31.42 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.972 1.309 . . . . 0.0 111.401 -174.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.55 142.43 17.98 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 123.78 2.987 . . . . 0.0 113.517 172.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.618 HD11 ' HA ' ' A' ' 10' ' ' ASN . 1.4 tm? -131.86 -47.12 0.94 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.799 1.64 . . . . 0.0 110.993 -169.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.419 HD21 HE21 ' A' ' 134' ' ' GLN . 10.9 tp -144.64 156.61 44.19 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.069 1.748 . . . . 0.0 108.79 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 91.4 m -146.55 146.93 30.66 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 110.031 173.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.7 mp -123.49 146.99 47.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 127.431 2.293 . . . . 0.0 109.08 -175.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 11.7 t -141.01 136.33 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.255 0.622 . . . . 0.0 111.912 -171.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.531 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.2 t -116.74 116.74 28.08 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.636 1.574 . . . . 0.0 110.594 178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 60.8 p -78.19 -12.67 60.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.929 1.292 . . . . 0.0 114.295 173.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 131.7 -0.05 4.94 Favored Glycine 0 CA--C 1.538 1.494 0 C-N-CA 125.312 1.434 . . . . 0.0 114.701 -177.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.3 p -153.81 157.66 39.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.794 1.297 . . . . 0.0 113.648 -176.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -58.81 136.61 87.02 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 126.332 1.853 . . . . 0.0 115.135 177.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -96.14 176.27 10.26 Favored 'Cis proline' 0 CA--C 1.548 1.212 0 CA-C-N 120.193 1.105 . . . . 0.0 110.584 -11.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.21 153.18 44.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.93 -1.107 . . . . 0.0 111.73 169.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -81.14 170.47 16.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.118 1.367 . . . . 0.0 110.474 169.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.419 HE21 HD21 ' A' ' 122' ' ' LEU . 43.3 mt-30 -138.22 147.28 43.59 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.05 1.74 . . . . 0.0 111.391 176.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.5 t -150.41 150.12 30.96 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.552 1.541 . . . . 0.0 110.946 173.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.37 137.2 44.56 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 169.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 30.05 59.28 0.19 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.203 2.201 . . . . 0.0 115.565 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.255 23.4 ptt85 47.1 28.26 0.91 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 127.594 2.358 . . . . 0.0 117.215 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -58.41 -31.94 68.18 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.8 p -89.6 -2.12 58.22 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 173.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.3 86.33 19.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 125.436 1.494 . . . . 0.0 111.245 -169.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo . . . . . 0 C--O 1.25 1.09 0 C-N-CA 123.602 2.868 . . . . 0.0 113.102 169.872 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.94 174.89 13.08 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.024 1.33 . . . . 0.0 112.112 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 47.9 p90 -60.71 164.18 4.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.736 1.614 . . . . 0.0 113.84 176.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.47 -21.02 0.14 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.428 1.013 . . . . 0.0 114.574 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -144.23 149.56 36.55 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.835 1.654 . . . . 0.0 110.958 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -143.56 -16.76 0.63 Allowed 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 -173.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -65.4 -32.48 74.13 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.235 1.38 . . . . 0.0 112.613 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.11 -46.8 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.147 169.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.95 -41.98 99.67 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.024 0.829 . . . . 0.0 112.387 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -62.08 -47.52 84.28 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.763 0.825 . . . . 0.0 112.589 173.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.6 m -61.28 -52.01 66.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 122.868 0.467 . . . . 0.0 110.833 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -63.05 -34.69 78.13 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 117.597 -1.192 . . . . 0.0 113.404 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.62 67.84 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.657 1.571 . . . . 0.0 111.389 174.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -66.29 -42.62 88.11 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.086 0.954 . . . . 0.0 111.991 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -60.52 -44.5 95.99 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.401 0.68 . . . . 0.0 112.15 171.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.9 m -57.64 -44.19 85.44 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.285 0.948 . . . . 0.0 111.424 174.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.4 -43.65 98.31 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.86 -44.05 94.29 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.645 -0.659 . . . . 0.0 112.246 175.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -65.43 -44.19 88.13 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.71 -0.619 . . . . 0.0 111.495 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -60.0 -41.73 92.73 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.529 0.732 . . . . 0.0 111.984 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.5 m -60.49 -42.97 97.4 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.069 0.85 . . . . 0.0 111.473 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.72 -40.71 92.47 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.833 -1.167 . . . . 0.0 113.225 173.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.97 -31.59 72.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.039 0.936 . . . . 0.0 113.005 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.0 tp -70.44 -36.85 74.19 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.789 1.236 . . . . 0.0 111.399 172.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -62.8 -44.88 94.99 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 121.056 -1.027 . . . . 0.0 111.8 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -54.07 -46.18 71.93 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.722 1.209 . . . . 0.0 111.796 170.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.49 -41.77 86.08 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 174.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.4 mt -62.41 -47.12 94.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 119.274 0.943 . . . . 0.0 110.512 173.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.05 -24.54 67.15 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.363 1.065 . . . . 0.0 113.775 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.06 -30.71 12.89 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.9 -27.58 66.85 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 120.218 1.372 . . . . 0.0 113.691 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -74.13 -25.43 59.76 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.25 -27.45 13.19 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.38 1.072 . . . . 0.0 113.63 -173.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.7 m -86.84 -7.67 58.01 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.58 -3.06 80.5 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 124.592 1.091 . . . . 0.0 115.522 172.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -146.37 151.96 45.05 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 127.83 2.452 . . . . 0.0 107.294 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -42.12 153.01 0.14 Allowed 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 124.375 3.383 . . . . 0.0 115.303 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 74.3 t -110.78 162.51 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 126.331 1.852 . . . . 0.0 108.822 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.28 176.24 35.29 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 116.611 1.404 . . . . 0.0 116.611 -175.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 4.4 mp -135.24 131.01 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 C-N-CA 125.378 1.471 . . . . 0.0 109.331 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -95.32 148.47 22.39 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.123 1.369 . . . . 0.0 110.928 173.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -138.79 143.36 38.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.079 1.752 . . . . 0.0 111.022 -173.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 77.8 p -142.05 176.37 9.01 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.734 1.614 . . . . 0.0 111.569 -173.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -53.94 -32.15 52.77 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 88.3 p -139.09 1.57 2.04 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -171.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.68 174.8 14.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.935 1.294 . . . . 0.0 112.598 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -143.02 159.99 41.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 127.044 2.138 . . . . 0.0 108.569 173.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 -152.49 150.72 29.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 169.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.88 144.04 12.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.772 0.829 . . . . 0.0 110.431 176.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -135.39 147.89 49.19 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.754 1.622 . . . . 0.0 110.958 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.6 m -140.75 161.91 51.68 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 125.063 1.345 . . . . 0.0 110.875 -170.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -49.76 144.74 19.56 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.238 2.625 . . . . 0.0 114.751 177.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.39 -156.42 7.87 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.017 1.294 . . . . 0.0 114.145 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -53.46 -22.1 7.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 -173.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.8 t -146.96 143.61 18.64 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.922 1.289 . . . . 0.0 112.158 -177.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.68 -10.98 12.94 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 123.66 2.907 . . . . 0.0 112.372 169.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.1 t -65.03 -25.31 67.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.948 1.299 . . . . 0.0 113.907 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.52 157.92 43.77 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.45 1.5 . . . . 0.0 111.209 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 44.3 t-105 -53.23 115.44 1.9 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.646 1.578 . . . . 0.0 112.079 177.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.4 tpp85 -155.89 152.22 28.03 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.241 1.416 . . . . 0.0 110.885 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -144.1 150.82 38.73 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -172.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 26.8 m -144.17 153.89 56.97 Favored Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 126.237 1.815 . . . . 0.0 110.191 169.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.31 147.84 72.85 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.137 1.891 . . . . 0.0 110.261 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.8 tp -78.16 52.98 1.15 Allowed 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.849 0.833 . . . . 0.0 111.037 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -128.83 18.71 6.15 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.442 1.497 . . . . 0.0 113.359 -169.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -63.14 -25.07 68.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.86 0.864 . . . . 0.0 113.052 172.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -149.46 -36.71 0.16 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.711 1.204 . . . . 0.0 113.406 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.74 29.46 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.645 1.578 . . . . 0.0 113.65 171.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.4 -37.63 49.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.177 1.791 . . . . 0.0 115.018 -169.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -103.59 12.09 35.37 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.466 1.507 . . . . 0.0 112.89 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -130.27 -33.74 1.68 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.752 1.221 . . . . 0.0 113.076 -172.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 75.2 m -75.63 9.15 2.41 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.186 1.394 . . . . 0.0 114.35 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -143.61 157.08 44.69 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.699 1.2 . . . . 0.0 112.67 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 40.64 -1.32 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 121.676 3.954 . . . . 0.0 121.676 170.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.12 -27.83 69.35 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 121.652 2.024 . . . . 0.0 114.588 -173.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.8 m0 -70.06 -17.07 63.23 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.141 1.376 . . . . 0.0 113.91 -174.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -136.68 152.39 50.34 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.607 1.563 . . . . 0.0 114.161 -169.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -141.97 -6.77 0.96 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -141.98 18.34 2.12 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.06 1.344 . . . . 0.0 111.972 -169.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -125.9 154.88 42.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.57 1.148 . . . . 0.0 112.824 -169.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.1 m -127.47 145.37 50.86 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 127.52 2.328 . . . . 0.0 108.518 169.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -118.04 148.67 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.592 1.157 . . . . 0.0 111.108 -169.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -138.06 151.28 47.69 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.27 1.828 . . . . 0.0 109.664 172.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.2 tt -148.02 146.03 28.74 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.893 0.877 . . . . 0.0 111.439 -174.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.69 153.63 43.28 Favored Pre-proline 0 N--CA 1.472 0.646 0 C-N-CA 125.775 1.63 . . . . 0.0 111.227 176.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -81.48 -13.31 37.45 Favored 'Cis proline' 0 CA--C 1.543 0.926 0 CA-C-N 120.542 1.229 . . . . 0.0 114.426 0.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -63.46 142.75 58.28 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.78 1.232 . . . . 0.0 112.945 -176.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -59.56 112.99 6.03 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 126.024 1.73 . . . . 0.0 111.67 172.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -86.03 -178.78 2.98 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.228 2.618 . . . . 0.0 112.407 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.1 t70 70.96 -44.95 0.6 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 119.104 3.001 . . . . 0.0 119.104 168.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -138.77 12.7 2.7 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -170.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.6 t -56.93 150.54 16.45 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -74.08 -11.52 60.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.898 1.279 . . . . 0.0 113.252 171.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.13 162.37 58.04 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 125.354 1.462 . . . . 0.0 111.507 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -65.14 140.28 64.45 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.503 1.468 . . . . 0.0 110.306 169.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -71.01 -22.0 62.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.668 0.787 . . . . 0.0 112.509 174.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 62.1 t -116.33 128.19 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.883 0.873 . . . . 0.0 109.753 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.3 t -131.18 140.84 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.478 1.111 . . . . 0.0 110.554 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.2 mp -126.53 124.24 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 126.575 1.95 . . . . 0.0 110.983 -169.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.7 mt -82.69 159.59 22.58 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 122.172 0.987 . . . . 0.0 112.041 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.35 -25.81 62.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.966 1.306 . . . . 0.0 114.345 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -87.64 -0.37 56.78 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 113.513 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 83.94 10.92 80.08 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.344 -0.847 . . . . 0.0 114.323 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -79.38 142.25 36.16 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.574 -0.957 . . . . 0.0 109.232 169.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -132.65 145.85 33.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 125.239 1.416 . . . . 0.0 109.094 -169.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.5 p -52.16 135.08 40.29 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 123.842 0.857 . . . . 0.0 112.286 169.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -70.78 123.48 9.8 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.763 2.309 . . . . 0.0 110.658 169.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.482 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 29.0 p90 -158.6 175.61 13.43 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.094 1.358 . . . . 0.0 112.14 175.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -137.68 144.72 41.94 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.227 1.411 . . . . 0.0 108.502 169.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.8 tp -136.85 116.15 12.63 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.658 1.983 . . . . 0.0 109.215 -169.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -110.42 146.35 36.02 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.953 1.301 . . . . 0.0 110.607 -175.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.4 mtt -126.11 138.24 53.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.773 1.629 . . . . 0.0 109.293 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -139.42 149.5 44.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.126 1.37 . . . . 0.0 111.69 -174.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -63.92 118.69 8.77 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.572 0.749 . . . . 0.0 110.699 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.29 -23.45 62.43 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -85.57 -17.69 61.6 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 123.873 0.749 . . . . 0.0 114.241 175.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.1 m -118.81 -24.55 6.6 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 118.21 1.005 . . . . 0.0 113.266 -169.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 64.29 33.82 88.27 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 123.604 0.621 . . . . 0.0 112.789 -171.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -125.93 127.04 24.84 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.59 1.556 . . . . 0.0 110.379 -170.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -51.74 148.01 23.02 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.204 3.269 . . . . 0.0 115.553 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.64 -51.76 1.93 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 127.101 2.16 . . . . 0.0 111.51 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -150.64 155.37 39.23 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.776 1.631 . . . . 0.0 108.637 -169.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.0 m -145.66 138.39 25.87 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 110.052 176.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.1 mp -111.2 149.22 31.27 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.363 2.265 . . . . 0.0 109.795 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 28.3 t -144.42 138.25 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.696 1.198 . . . . 0.0 111.871 -169.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.482 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 14.1 t -117.28 158.18 24.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.433 1.493 . . . . 0.0 112.125 178.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 83.0 p -133.06 -2.02 3.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.727 1.611 . . . . 0.0 114.311 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 125.3 -14.33 7.36 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.912 1.244 . . . . 0.0 115.101 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 55.7 m -142.35 152.55 43.01 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.826 1.251 . . . . 0.0 112.436 -172.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 47.5 t-105 -53.7 134.68 55.32 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.471 1.509 . . . . 0.0 114.678 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -99.9 178.2 6.05 Favored 'Cis proline' 0 CA--C 1.55 1.276 0 CA-C-N 120.53 1.225 . . . . 0.0 111.272 -11.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.461 HD21 ' CZ ' ' A' ' 108' ' ' PHE . 3.7 mp -67.76 168.6 11.11 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.191 -0.943 . . . . 0.0 112.079 169.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -114.08 164.6 13.61 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.389 1.475 . . . . 0.0 109.654 171.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -142.88 156.33 44.9 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.2 t -151.5 154.64 36.94 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.37 1.868 . . . . 0.0 111.084 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.01 133.82 47.64 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.494 -0.754 . . . . 0.0 109.047 169.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.82 63.1 0.13 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.646 1.978 . . . . 0.0 115.637 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 55.7 ptt85 46.46 25.77 0.43 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 127.83 2.452 . . . . 0.0 117.252 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.63 -33.62 71.74 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 -174.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.9 p -77.48 -20.95 53.59 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 20.1 mtp-105 -74.07 152.51 88.52 Favored Pre-proline 0 N--CA 1.475 0.795 0 C-N-CA 124.073 0.949 . . . . 0.0 112.768 -170.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 C--O 1.249 1.048 0 C-N-CA 123.788 2.992 . . . . 0.0 113.172 177.497 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 tpp . . . . . 0 N--CA 1.488 1.474 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.3 151.77 33.45 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.038 1.335 . . . . 0.0 111.293 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -161.14 105.99 1.35 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.958 1.703 . . . . 0.0 108.414 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -41.35 -29.52 0.4 Allowed Glycine 0 N--CA 1.482 1.715 0 C-N-CA 127.475 2.464 . . . . 0.0 118.217 -169.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.3 ttp-105 -51.76 -22.6 3.72 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.034 1.734 . . . . 0.0 113.179 169.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -51.5 -20.99 2.13 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.665 1.986 . . . . 0.0 115.511 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.16 -36.43 79.79 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 120.126 1.33 . . . . 0.0 112.782 170.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.8 t -70.16 -41.84 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.62 0.768 . . . . 0.0 110.127 173.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.8 -39.88 95.65 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.666 -0.646 . . . . 0.0 112.586 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -62.01 -46.34 89.62 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.682 0.793 . . . . 0.0 111.804 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.0 m -55.75 -53.81 52.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.143 0.577 . . . . 0.0 110.73 174.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 88.1 mmt-85 -62.12 -36.11 80.77 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 117.488 -1.244 . . . . 0.0 112.661 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.1 66.68 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 121.103 1.774 . . . . 0.0 111.722 174.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -63.87 -42.39 97.54 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.063 1.345 . . . . 0.0 111.666 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -64.79 -44.72 89.02 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.775 1.63 . . . . 0.0 112.99 174.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -62.92 -38.68 91.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.388 1.075 . . . . 0.0 111.273 175.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.09 84.24 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.57 -43.75 98.28 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.705 -0.622 . . . . 0.0 111.954 173.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -61.05 -48.95 79.38 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.787 1.235 . . . . 0.0 111.446 177.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -61.02 -42.29 98.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.779 -0.629 . . . . 0.0 112.399 174.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.9 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.439 1.018 . . . . 0.0 111.013 176.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.31 -42.22 99.0 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.973 -1.079 . . . . 0.0 113.396 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.1 -33.78 76.55 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.228 -0.92 . . . . 0.0 112.882 177.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.7 tp -71.3 -31.89 67.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.875 1.27 . . . . 0.0 111.797 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -62.97 -44.57 95.68 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.07 -1.019 . . . . 0.0 110.69 169.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 tp -54.02 -46.57 71.85 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.805 1.242 . . . . 0.0 111.468 169.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.0 -45.31 90.96 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.1 mt -61.98 -46.22 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 110.863 175.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -62.74 -33.37 75.0 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.933 0.893 . . . . 0.0 113.025 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -82.06 -27.03 33.18 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.247 1.019 . . . . 0.0 113.562 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.08 -38.32 85.83 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.927 1.24 . . . . 0.0 114.26 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.6 t -68.82 -32.5 72.25 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.407 -0.808 . . . . 0.0 112.144 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.86 -32.96 59.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.383 1.473 . . . . 0.0 112.804 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 75.0 m -72.23 -24.58 61.4 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.516 1.526 . . . . 0.0 114.446 -174.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.27 13.2 64.54 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 123.749 0.69 . . . . 0.0 114.153 -174.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -152.96 150.61 24.59 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 128.893 2.877 . . . . 0.0 107.178 -178.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -50.24 161.36 1.13 Allowed 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.616 2.211 . . . . 0.0 112.824 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.0 t -122.55 159.65 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 125.15 1.38 . . . . 0.0 108.214 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -157.86 -174.8 28.02 Favored Glycine 0 N--CA 1.464 0.563 0 O-C-N 120.603 -1.31 . . . . 0.0 115.155 -176.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -125.64 127.96 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 C-N-CA 124.491 1.116 . . . . 0.0 108.963 174.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -97.71 98.12 9.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.575 1.55 . . . . 0.0 108.275 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -84.85 126.55 33.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.54 1.136 . . . . 0.0 109.162 171.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 87.9 p -126.34 9.17 7.23 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -175.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 64.66 -37.46 0.21 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 128.338 2.655 . . . . 0.0 114.84 -172.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.4 p -62.66 -40.89 98.48 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.197 1.399 . . . . 0.0 111.516 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.8 -174.66 4.03 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 128.061 2.545 . . . . 0.0 109.29 169.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -147.63 135.1 20.78 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.108 -0.995 . . . . 0.0 110.492 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.37 151.28 39.07 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.769 1.228 . . . . 0.0 112.383 -173.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 27.1 mt -71.54 149.19 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.546 0.738 . . . . 0.0 109.142 171.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 6.0 ttt -138.55 139.53 38.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.228 1.411 . . . . 0.0 110.3 -172.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.5 m -143.54 164.55 30.0 Favored Pre-proline 0 N--CA 1.479 1.023 0 C-N-CA 126.492 1.917 . . . . 0.0 111.286 -169.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -68.01 164.46 31.82 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 121.787 1.658 . . . . 0.0 111.791 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.63 -59.69 0.01 OUTLIER Glycine 0 N--CA 1.472 1.066 0 CA-C-O 119.568 -0.573 . . . . 0.0 114.183 177.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -65.81 -30.78 71.46 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 118.272 1.036 . . . . 0.0 113.763 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.5 t -157.11 138.71 9.89 Favored Pre-proline 0 N--CA 1.471 0.616 0 C-N-CA 124.608 1.163 . . . . 0.0 110.95 169.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -87.05 4.69 6.08 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.266 3.311 . . . . 0.0 113.399 171.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 78.2 p -45.72 -58.54 3.38 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -169.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -162.95 -36.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.126 1.371 . . . . 0.0 113.462 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -152.84 106.22 3.03 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.818 0.847 . . . . 0.0 112.118 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.1 tpp85 -155.9 151.58 27.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.338 1.855 . . . . 0.0 109.607 169.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -144.54 135.83 25.36 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 15.7 m -143.01 151.64 56.5 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 128.255 2.622 . . . . 0.0 108.953 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -66.06 135.28 40.02 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 122.222 1.948 . . . . 0.0 111.095 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 tt -71.63 88.55 0.96 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.539 1.136 . . . . 0.0 109.317 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -135.74 -10.51 2.09 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -58.54 -27.68 64.76 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.651 1.114 . . . . 0.0 113.845 -177.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -135.94 24.56 3.33 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.454 1.902 . . . . 0.0 112.776 174.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.56 35.37 2.46 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.856 2.062 . . . . 0.0 109.718 172.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.72 118.58 4.34 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.049 1.74 . . . . 0.0 112.648 -169.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.1 t70 54.32 21.77 3.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.886 1.674 . . . . 0.0 115.101 -177.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -133.69 -12.18 2.66 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.9 t -63.87 -24.46 67.75 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.242 1.017 . . . . 0.0 113.551 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -151.6 165.61 33.77 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.762 1.225 . . . . 0.0 113.269 -177.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.74 -37.13 0.06 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 129.398 3.079 . . . . 0.0 116.66 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.91 -6.58 22.61 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.016 2.126 . . . . 0.0 113.935 173.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 77.6 m95 -42.97 -48.45 5.93 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.395 1.878 . . . . 0.0 114.574 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -158.16 -178.41 7.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.142 1.377 . . . . 0.0 112.549 -169.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -139.12 18.17 2.61 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.116 1.366 . . . . 0.0 112.922 171.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -146.93 -2.99 0.6 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.0 mt -118.08 160.08 22.12 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 -169.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.5 t -132.74 133.72 43.84 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 127.93 2.492 . . . . 0.0 107.802 169.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -109.66 145.62 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.542 1.137 . . . . 0.0 111.038 -169.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -136.99 155.2 50.01 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.965 1.706 . . . . 0.0 110.713 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.2 tt -145.62 147.36 31.95 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.604 1.161 . . . . 0.0 112.523 -169.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' N ' HD23 ' A' ' 84' ' ' LEU . 5.0 pp0? -154.03 153.44 28.49 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 126.282 1.833 . . . . 0.0 109.607 168.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -76.5 -13.62 27.25 Favored 'Cis proline' 0 CA--C 1.543 0.963 0 CA-C-N 120.84 1.336 . . . . 0.0 113.938 -2.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -67.85 173.15 4.64 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.339 1.056 . . . . 0.0 111.953 171.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.13 135.06 26.84 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.725 1.21 . . . . 0.0 112.449 -173.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.89 100.05 1.34 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.474 2.783 . . . . 0.0 109.87 174.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -159.93 141.85 13.02 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.321 1.449 . . . . 0.0 110.571 -171.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -59.83 87.05 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.736 1.214 . . . . 0.0 112.131 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.4 m -101.93 -6.57 23.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.361 1.864 . . . . 0.0 113.085 -169.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.0 20.97 4.63 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 126.729 2.011 . . . . 0.0 114.277 -177.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -157.29 163.47 24.83 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 127.244 2.218 . . . . 0.0 108.624 175.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.58 155.63 66.01 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 CA-C-N 120.26 1.129 . . . . 0.0 110.883 169.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -107.2 -44.88 4.25 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.088 0.555 . . . . 0.0 110.826 170.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.0 t -79.47 132.47 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 92.8 t -134.08 145.29 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.997 0.919 . . . . 0.0 111.865 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -123.72 131.53 72.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 C-N-CA 129.644 3.178 . . . . 0.0 107.984 -172.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.8 mt -96.43 157.72 15.77 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.279 0.562 . . . . 0.0 111.151 169.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.64 -22.73 47.29 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.28 -18.62 61.78 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.802 1.641 . . . . 0.0 113.507 174.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.36 5.18 63.75 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 124.933 1.254 . . . . 0.0 114.611 -176.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -83.29 144.25 29.84 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 118.323 1.062 . . . . 0.0 108.99 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 3.8 mm -131.47 150.27 34.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 125.334 1.454 . . . . 0.0 110.088 -168.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.6 p -57.59 121.91 52.13 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.685 169.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.36 127.98 28.22 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 122.736 2.29 . . . . 0.0 113.373 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -161.48 175.17 12.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.069 1.348 . . . . 0.0 112.558 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 79.1 p -136.42 150.02 48.56 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 123.749 0.82 . . . . 0.0 111.044 168.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.0 tp -130.38 106.35 8.49 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.795 2.038 . . . . 0.0 108.041 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -98.48 145.46 26.75 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.924 1.29 . . . . 0.0 110.022 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.2 mtt -128.67 128.96 45.13 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.905 1.682 . . . . 0.0 108.895 -178.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.7 144.28 50.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 124.99 1.316 . . . . 0.0 110.764 -178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -69.61 104.54 2.4 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.089 1.356 . . . . 0.0 110.004 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.62 -20.98 66.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.625 1.17 . . . . 0.0 114.132 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -99.14 -7.19 55.2 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.775 1.179 . . . . 0.0 114.818 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.2 m -124.17 -29.11 3.62 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.579 1.152 . . . . 0.0 112.327 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 103.24 22.66 9.01 Favored Glycine 0 CA--C 1.534 1.275 0 N-CA-C 116.659 1.424 . . . . 0.0 116.659 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -140.18 143.46 33.8 Favored Pre-proline 0 N--CA 1.477 0.887 0 CA-C-N 119.491 1.645 . . . . 0.0 112.972 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.67 147.86 29.74 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.784 2.989 . . . . 0.0 113.503 169.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.87 -47.49 1.14 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.156 1.382 . . . . 0.0 112.513 -169.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -151.65 154.21 35.94 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.973 1.309 . . . . 0.0 108.954 -174.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 57.9 m -146.07 141.39 27.55 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 120.896 -1.127 . . . . 0.0 110.26 176.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.9 mp -113.35 148.95 34.73 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 126.589 1.955 . . . . 0.0 108.911 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.2 t -141.57 137.2 32.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.444 0.698 . . . . 0.0 111.875 -173.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.76 113.98 21.45 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.152 1.381 . . . . 0.0 110.94 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 24.7 m -75.52 -12.85 60.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 173.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 139.91 -3.09 2.5 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 124.851 1.215 . . . . 0.0 115.547 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 9.5 t -151.81 153.43 34.23 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.306 1.553 . . . . 0.0 112.87 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 21.5 t-105 -59.97 141.48 89.78 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 126.145 1.778 . . . . 0.0 115.244 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -91.44 176.05 17.44 Favored 'Cis proline' 0 CA--C 1.544 0.992 0 CA-C-N 119.793 0.962 . . . . 0.0 110.88 -11.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -67.96 152.69 45.14 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 122.226 1.012 . . . . 0.0 111.906 170.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.96 169.38 16.85 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.169 1.387 . . . . 0.0 109.523 169.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -137.51 147.21 45.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.339 1.456 . . . . 0.0 111.652 178.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.2 t -152.13 154.57 36.14 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.247 1.419 . . . . 0.0 110.992 174.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.97 133.84 41.62 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 31.77 61.37 0.29 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.752 2.021 . . . . 0.0 115.551 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.305 0.0 OUTLIER 49.64 11.3 0.05 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 128.528 2.731 . . . . 0.0 118.209 -176.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.18 -34.07 63.54 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 3.2 m -91.68 -10.15 41.26 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.484 1.113 . . . . 0.0 113.288 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -64.97 -41.54 55.5 Favored Pre-proline 0 N--CA 1.478 0.961 0 CA-C-O 116.508 -1.711 . . . . 0.0 115.029 -176.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo . . . . . 0 C--O 1.25 1.114 0 C-N-CA 124.317 3.345 . . . . 0.0 115.349 176.558 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.0 ptp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.66 172.42 13.02 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.437 1.495 . . . . 0.0 111.452 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -73.32 50.65 0.31 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.644 1.978 . . . . 0.0 114.273 -176.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -178.94 115.83 0.5 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 126.61 2.052 . . . . 0.0 110.395 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.0 ttm-85 48.81 41.02 17.59 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.299 1.44 . . . . 0.0 112.299 -169.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.19 -42.2 2.94 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 128.014 2.526 . . . . 0.0 113.306 170.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -153.74 -30.69 0.12 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.54 1.536 . . . . 0.0 112.594 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.75 -29.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 117.141 2.275 . . . . 0.0 117.141 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -43.09 -53.24 5.02 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 117.299 2.333 . . . . 0.0 117.299 -167.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 121' ' ' LEU . 18.6 t-20 -65.51 -21.11 66.59 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -178.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.7 m -93.43 -51.95 4.74 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.221 1.409 . . . . 0.0 110.487 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 tpt85 -59.23 -33.81 71.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.012 2.125 . . . . 0.0 113.091 -177.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.05 95.11 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.434 1.47 . . . . 0.0 112.597 173.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -67.04 -41.67 86.15 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.464 1.106 . . . . 0.0 110.871 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.07 -41.46 99.44 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.635 0.774 . . . . 0.0 112.168 172.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.6 m -61.13 -41.6 97.02 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.406 1.082 . . . . 0.0 111.184 175.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.09 -41.14 91.07 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 175.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.12 -45.54 91.52 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.517 -0.739 . . . . 0.0 111.884 173.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -58.47 -46.99 85.5 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.299 1.439 . . . . 0.0 111.038 174.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -63.58 -42.88 98.26 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.44 1.096 . . . . 0.0 112.688 177.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.7 m -61.7 -44.73 96.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 118.727 0.694 . . . . 0.0 110.864 176.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.25 -41.79 98.76 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.144 -0.972 . . . . 0.0 113.082 173.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.09 -31.33 70.87 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.263 -0.898 . . . . 0.0 113.374 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.6 tp -71.15 -32.79 69.37 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.482 1.113 . . . . 0.0 111.414 171.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.54 -44.01 95.45 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 120.913 -1.117 . . . . 0.0 110.644 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.23 -44.75 68.34 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.048 1.339 . . . . 0.0 111.236 169.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.79 -40.63 97.93 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 176.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.6 mt -64.09 -44.99 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.744 0.817 . . . . 0.0 110.718 173.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -60.6 -39.37 87.89 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.347 0.659 . . . . 0.0 112.56 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -32.82 63.18 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.378 -0.826 . . . . 0.0 112.126 174.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -36.29 83.38 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 120.121 1.328 . . . . 0.0 112.48 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -21.92 60.46 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.902 -0.499 . . . . 0.0 112.268 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.38 -28.79 14.3 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.638 1.175 . . . . 0.0 113.216 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.5 m -77.55 -28.87 52.0 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -172.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.42 9.32 84.46 Favored Glycine 0 CA--C 1.542 1.771 0 CA-C-N 119.12 0.873 . . . . 0.0 114.629 -172.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -140.76 144.34 35.51 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 127.89 2.476 . . . . 0.0 106.637 169.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.71 158.61 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.651 2.901 . . . . 0.0 114.785 169.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.0 t -115.57 164.92 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.867 2.067 . . . . 0.0 108.204 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -155.99 174.53 33.91 Favored Glycine 0 N--CA 1.465 0.611 0 CA-C-N 120.402 1.456 . . . . 0.0 115.788 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 138.04 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.55 1.14 . . . . 0.0 108.773 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -114.89 125.59 53.82 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 127.109 2.163 . . . . 0.0 109.299 -169.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -127.26 127.1 43.85 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 110.895 -171.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.5 t -147.19 167.08 25.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.028 1.331 . . . . 0.0 112.053 177.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.33 -28.02 67.63 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.409 1.083 . . . . 0.0 112.697 173.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 p -71.88 -54.19 10.84 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.034 1.334 . . . . 0.0 112.58 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -162.66 173.4 13.94 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.356 2.262 . . . . 0.0 110.336 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -136.25 153.36 51.22 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.939 0.896 . . . . 0.0 111.508 169.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.8 ptp85 -158.28 163.21 37.61 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.822 1.249 . . . . 0.0 113.955 -170.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.9 mt -92.91 144.89 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.929 0.891 . . . . 0.0 109.724 170.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 92.0 mtp -134.45 149.79 50.78 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.964 1.706 . . . . 0.0 110.645 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.0 p -141.62 156.07 66.54 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.979 1.711 . . . . 0.0 111.299 -168.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -58.31 -29.99 89.65 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.085 2.523 . . . . 0.0 114.066 169.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 67.4 -68.47 0.25 Allowed Glycine 0 CA--C 1.529 0.942 0 C-N-CA 127.466 2.46 . . . . 0.0 115.496 169.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -135.6 -20.75 1.56 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.345 1.858 . . . . 0.0 114.436 -169.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.48 48.01 3.04 Favored Pre-proline 0 N--CA 1.485 1.281 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -169.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -65.82 4.69 0.79 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 123.973 3.115 . . . . 0.0 114.741 178.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.0 m -44.88 -33.79 2.1 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 129.184 2.994 . . . . 0.0 115.573 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -154.04 -51.65 0.1 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.552 1.141 . . . . 0.0 111.749 169.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.8 t-105 -158.91 125.3 4.58 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.478 1.511 . . . . 0.0 110.468 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -152.65 154.13 34.71 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.234 1.413 . . . . 0.0 111.14 174.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -141.87 151.0 42.29 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.823 1.249 . . . . 0.0 112.534 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.3 p -159.45 149.54 15.16 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 127.992 2.517 . . . . 0.0 108.12 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.28 140.22 42.77 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.577 2.185 . . . . 0.0 112.813 169.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.74 64.27 2.98 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.272 1.029 . . . . 0.0 110.371 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -131.05 5.65 4.53 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.658 1.583 . . . . 0.0 113.086 -170.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -62.03 -18.21 59.84 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.655 1.182 . . . . 0.0 113.961 176.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -133.85 -33.09 1.07 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.162 1.385 . . . . 0.0 113.026 173.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.82 -11.94 61.05 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 174.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.32 -55.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 129.934 3.294 . . . . 0.0 116.574 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.5 -15.15 0.24 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.778 1.631 . . . . 0.0 113.894 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -62.42 -21.29 65.29 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 120.801 -1.187 . . . . 0.0 114.085 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.0 m -76.65 -2.3 32.02 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.455 1.502 . . . . 0.0 114.735 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -141.22 165.42 27.58 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 120.107 1.322 . . . . 0.0 112.863 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 41.2 t30 47.73 -52.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 130.362 3.465 . . . . 0.0 119.684 169.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -55.46 -13.68 1.61 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 127.412 2.285 . . . . 0.0 113.442 169.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 28.6 m95 -43.07 -30.26 0.42 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 126.964 2.106 . . . . 0.0 115.604 169.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -149.17 154.88 39.81 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.928 1.24 . . . . 0.0 112.972 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -145.62 -19.64 0.47 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -177.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -136.99 16.35 3.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.548 1.539 . . . . 0.0 111.311 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -129.61 156.45 44.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.944 1.698 . . . . 0.0 110.532 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 68.2 m -125.44 130.65 52.26 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.288 1.835 . . . . 0.0 109.013 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.97 139.3 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.594 1.158 . . . . 0.0 110.06 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 -137.48 122.18 18.64 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.505 1.522 . . . . 0.0 109.357 -176.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -114.15 145.11 42.1 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.972 1.309 . . . . 0.0 111.994 -169.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -156.62 153.48 24.78 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.364 1.865 . . . . 0.0 110.19 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -75.02 -15.22 22.56 Favored 'Cis proline' 0 CA--C 1.542 0.887 0 CA-C-N 120.347 1.16 . . . . 0.0 113.69 -3.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -61.06 125.57 24.2 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.202 1.001 . . . . 0.0 111.801 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 134.72 89.61 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 124.183 0.993 . . . . 0.0 112.52 177.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.98 108.64 2.36 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 123.049 2.5 . . . . 0.0 109.627 172.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -159.51 145.93 16.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.473 1.109 . . . . 0.0 111.851 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -75.85 48.22 0.46 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.446 1.498 . . . . 0.0 112.618 174.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.8 m -58.31 156.18 10.44 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.903 1.681 . . . . 0.0 113.207 -176.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -67.8 5.09 0.93 Allowed 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -159.45 164.35 20.82 Favored Pre-proline 0 CA--C 1.542 0.649 0 C-N-CA 127.346 2.258 . . . . 0.0 109.889 -176.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.89 149.68 83.13 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 121.407 1.405 . . . . 0.0 110.01 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -94.1 -42.81 8.8 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.039 -0.413 . . . . 0.0 111.987 176.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.5 t -73.79 138.53 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.227 1.011 . . . . 0.0 109.194 169.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 85.5 t -136.13 144.94 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.717 0.807 . . . . 0.0 111.772 -176.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.45 118.0 48.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 128.885 2.874 . . . . 0.0 108.072 -173.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.7 mt -82.53 163.41 21.54 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 122.275 1.036 . . . . 0.0 111.952 177.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.88 -13.69 11.99 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -176.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -120.12 9.44 11.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.604 1.561 . . . . 0.0 113.308 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 95.31 9.25 58.12 Favored Glycine 0 CA--C 1.534 1.257 0 N-CA-C 115.788 1.075 . . . . 0.0 115.788 174.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -75.49 136.56 40.63 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 118.942 1.371 . . . . 0.0 108.178 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.2 mm -130.14 144.69 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.706 1.203 . . . . 0.0 109.551 -172.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.6 p -54.75 133.56 65.44 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 121.656 -0.653 . . . . 0.0 110.931 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.49 98.49 1.18 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.506 2.137 . . . . 0.0 111.466 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 22.4 p90 -124.48 177.28 6.0 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.045 1.738 . . . . 0.0 111.945 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.2 t -140.26 145.57 37.49 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.802 1.241 . . . . 0.0 110.299 172.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 7.7 tp -130.45 92.14 3.21 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.128 2.171 . . . . 0.0 109.602 -169.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.1 tt -80.75 143.73 32.69 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.962 0.905 . . . . 0.0 109.921 176.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 63.2 mtt -127.31 133.11 50.15 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 126.028 1.731 . . . . 0.0 108.309 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.46 143.49 51.17 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.907 1.283 . . . . 0.0 110.693 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -66.92 109.46 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.764 0.826 . . . . 0.0 110.901 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.37 64.57 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.88 -0.04 75.57 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 125.653 1.597 . . . . 0.0 114.429 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -129.85 -37.45 1.53 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.704 1.201 . . . . 0.0 113.143 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 88.49 30.18 16.82 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 118.515 0.598 . . . . 0.0 114.014 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -141.65 139.67 18.95 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.123 1.369 . . . . 0.0 111.225 -169.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -49.61 144.63 18.93 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.912 3.075 . . . . 0.0 114.182 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.466 HD11 ' HA ' ' A' ' 10' ' ' ASN . 1.5 tm? -130.68 -50.08 1.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.085 1.754 . . . . 0.0 110.603 -169.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -138.47 162.84 33.48 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.74 1.616 . . . . 0.0 110.174 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 9.4 m -147.99 117.51 7.01 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 123.882 0.873 . . . . 0.0 109.188 176.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.5 mp -92.4 149.51 21.36 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.8 1.24 . . . . 0.0 109.918 173.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 2.8 t -145.07 136.45 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.417 1.087 . . . . 0.0 112.056 -169.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 18.0 t -120.62 160.26 23.61 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.905 1.682 . . . . 0.0 111.442 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 82.1 p -137.72 -0.4 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -174.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.34 -11.6 5.8 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.613 1.102 . . . . 0.0 115.004 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.2 p -157.6 158.67 36.0 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.235 -1.156 . . . . 0.0 113.513 -173.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 131' ' ' PRO . 29.6 t-105 -60.69 140.11 92.95 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 126.309 1.843 . . . . 0.0 114.991 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 130' ' ' TRP . 42.6 Cg_endo -96.1 176.98 9.71 Favored 'Cis proline' 0 CA--C 1.546 1.114 0 CA-C-N 119.969 1.025 . . . . 0.0 111.281 -11.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.9 mp -69.35 168.14 14.98 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 122.133 0.968 . . . . 0.0 111.096 169.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -114.71 164.29 14.26 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.158 1.383 . . . . 0.0 109.434 169.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -140.46 149.83 43.03 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.362 1.065 . . . . 0.0 112.484 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.1 t -145.62 150.28 36.06 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.149 1.38 . . . . 0.0 111.181 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.85 132.19 46.35 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.781 -0.574 . . . . 0.0 109.478 169.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.91 66.37 0.07 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.472 2.309 . . . . 0.0 115.939 176.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.76 7.81 4.11 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 175.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -57.74 -31.28 66.32 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 116.31 1.967 . . . . 0.0 116.31 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.9 p -99.09 -6.33 28.59 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -63.64 -35.77 18.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 117.277 2.325 . . . . 0.0 117.277 -169.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo . . . . . 0 C--O 1.25 1.094 0 C-N-CA 124.111 3.207 . . . . 0.0 115.307 177.865 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.13 -11.53 6.29 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -176.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -75.22 -23.24 57.56 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.093 1.357 . . . . 0.0 113.528 173.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.25 67.51 1.47 Allowed Glycine 0 CA--C 1.532 1.132 0 C-N-CA 127.002 2.239 . . . . 0.0 115.017 -169.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -118.57 7.94 11.89 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.126 1.771 . . . . 0.0 113.241 -173.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -50.04 -37.38 32.97 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 -169.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -71.12 -41.11 70.95 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.836 1.198 . . . . 0.0 112.767 176.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 46.4 t -66.96 -45.01 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.693 0.797 . . . . 0.0 109.825 173.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.48 -38.69 90.83 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.105 0.962 . . . . 0.0 112.512 176.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -63.11 -49.28 75.03 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.749 1.159 . . . . 0.0 111.671 172.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.2 m -57.77 -52.41 65.59 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.136 0.574 . . . . 0.0 110.584 177.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -65.48 -30.75 71.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.685 1.194 . . . . 0.0 113.728 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.35 -48.75 78.43 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.743 1.61 . . . . 0.0 110.778 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -66.41 -38.94 88.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.887 1.275 . . . . 0.0 111.513 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.53 -46.06 87.73 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.612 0.765 . . . . 0.0 112.191 169.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.3 m -57.56 -40.08 78.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.857 0.863 . . . . 0.0 111.27 175.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.06 -44.58 84.11 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.46 -43.51 97.15 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.357 -0.839 . . . . 0.0 111.913 174.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -62.15 -45.56 92.91 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.948 1.699 . . . . 0.0 111.515 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -59.13 -47.46 85.21 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.463 1.105 . . . . 0.0 112.242 170.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.5 m -58.24 -41.56 84.45 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 118.871 0.759 . . . . 0.0 110.725 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.32 -41.02 94.44 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.051 -1.031 . . . . 0.0 113.715 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.23 -32.78 74.5 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.148 -0.97 . . . . 0.0 113.094 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.3 tp -74.08 -35.11 64.2 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.848 1.259 . . . . 0.0 111.602 174.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -61.53 -46.25 90.75 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.994 -1.066 . . . . 0.0 111.067 169.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 tp -51.98 -47.45 64.85 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.322 1.449 . . . . 0.0 111.262 169.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.43 85.93 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 69.9 mt -66.05 -47.95 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.411 1.005 . . . . 0.0 110.659 174.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -59.83 -39.24 84.4 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.807 -0.558 . . . . 0.0 112.007 175.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -69.17 -38.72 78.86 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.362 -0.836 . . . . 0.0 112.391 175.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.26 73.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.449 1.022 . . . . 0.0 112.712 174.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.08 -20.41 55.79 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.687 0.676 . . . . 0.0 112.551 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.48 -27.19 14.17 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.613 1.165 . . . . 0.0 113.702 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.7 m -89.83 -14.03 35.28 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -169.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.34 -1.36 81.67 Favored Glycine 0 CA--C 1.542 1.723 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -140.83 149.98 58.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 127.861 2.464 . . . . 0.0 107.25 172.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -45.95 164.67 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 124.305 3.337 . . . . 0.0 115.528 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.8 t -123.12 159.3 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.431 1.893 . . . . 0.0 108.353 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.35 -178.79 32.71 Favored Glycine 0 N--CA 1.465 0.574 0 O-C-N 120.721 -1.237 . . . . 0.0 115.402 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.8 mt -131.27 111.95 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.42 1.088 . . . . 0.0 110.333 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -83.36 78.29 9.66 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.206 1.803 . . . . 0.0 110.269 175.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -64.99 120.36 12.46 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 168.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 t -125.99 -179.6 4.77 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.25 1.42 . . . . 0.0 113.079 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -63.34 -24.78 68.0 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -169.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.1 m -135.08 -9.72 2.29 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -175.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -161.16 -175.68 5.01 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.959 2.104 . . . . 0.0 109.365 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -136.6 151.48 49.38 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.302 1.041 . . . . 0.0 109.583 169.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -141.08 151.34 43.92 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.2 mm -76.65 137.33 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 169.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.1 mtm -128.89 150.4 50.37 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.049 1.34 . . . . 0.0 111.371 175.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.65 163.28 51.74 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 126.98 2.112 . . . . 0.0 111.261 -168.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -54.49 160.95 6.24 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 124.085 3.19 . . . . 0.0 114.825 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -120.22 -136.35 5.17 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.587 1.089 . . . . 0.0 113.715 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -46.54 -35.79 6.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 126.37 1.868 . . . . 0.0 114.68 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 t -146.45 142.13 17.09 Favored Pre-proline 0 N--CA 1.47 0.572 0 C-N-CA 124.805 1.242 . . . . 0.0 111.696 174.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.6 -10.0 14.59 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.488 2.792 . . . . 0.0 112.55 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 t -71.13 -17.3 62.57 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.057 1.343 . . . . 0.0 114.157 -173.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.62 163.7 33.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.489 1.516 . . . . 0.0 111.611 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 55.0 t-105 -58.32 112.4 1.55 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.844 1.257 . . . . 0.0 111.911 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.1 tpt85 -157.04 143.18 17.96 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.699 1.599 . . . . 0.0 109.992 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -136.52 153.63 50.96 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.553 1.141 . . . . 0.0 112.81 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.4 t -150.3 140.33 13.86 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 128.079 2.552 . . . . 0.0 108.366 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -51.46 145.32 29.1 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.474 2.116 . . . . 0.0 111.787 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.4 tp -66.44 12.7 0.06 Allowed 'General case' 0 CA--C 1.554 1.134 0 O-C-N 120.576 -1.328 . . . . 0.0 114.185 176.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -64.93 -7.77 12.9 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.998 -1.688 . . . . 0.0 113.576 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -57.46 -25.78 60.23 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.031 1.333 . . . . 0.0 112.122 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -137.21 -42.19 0.57 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.607 1.163 . . . . 0.0 112.964 170.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.35 48.3 1.01 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.014 1.325 . . . . 0.0 111.492 175.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.31 -34.66 10.88 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.707 1.603 . . . . 0.0 115.099 -169.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -123.92 13.5 9.16 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.743 2.017 . . . . 0.0 113.286 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -133.39 -5.16 2.97 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.242 1.417 . . . . 0.0 113.942 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.0 t -54.88 -34.29 62.83 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.263 1.025 . . . . 0.0 112.819 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -118.91 140.21 50.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.62 1.568 . . . . 0.0 112.506 178.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 23.83 -115.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 127.429 2.292 . . . . 0.0 114.152 -169.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.0 t70 54.41 29.92 11.84 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.351 1.46 . . . . 0.0 113.718 -169.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -115.85 -21.25 9.66 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.972 1.709 . . . . 0.0 113.21 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -141.6 170.65 15.33 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.952 1.301 . . . . 0.0 113.537 -175.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -143.0 8.24 1.65 Allowed 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 169.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.36 9.41 1.08 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 125.053 1.341 . . . . 0.0 114.213 -175.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.96 160.86 23.96 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.414 -1.429 . . . . 0.0 112.097 -169.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.6 m -128.78 134.47 48.4 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 126.759 2.024 . . . . 0.0 108.825 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -104.61 146.98 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 124.292 1.037 . . . . 0.0 110.226 -173.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -138.18 160.9 38.21 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.663 1.985 . . . . 0.0 109.81 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 53.5 mt -125.97 160.84 28.93 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.664 1.186 . . . . 0.0 112.424 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -148.0 130.58 7.8 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 126.948 2.099 . . . . 0.0 108.284 176.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -79.0 -5.21 37.48 Favored 'Cis proline' 0 CA--C 1.548 1.224 0 CA-C-N 121.671 1.633 . . . . 0.0 113.146 -10.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -65.99 -178.83 0.65 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.177 1.791 . . . . 0.0 112.724 176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.6 138.87 25.44 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 124.485 1.114 . . . . 0.0 112.897 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.72 99.88 1.2 Allowed 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.72 2.947 . . . . 0.0 109.704 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -156.46 154.39 30.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.663 1.185 . . . . 0.0 111.67 -169.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -76.06 53.08 0.76 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.925 1.69 . . . . 0.0 113.51 -171.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 84.0 p -67.38 -12.85 61.25 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.426 1.49 . . . . 0.0 114.119 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.9 25.81 14.98 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.406 1.883 . . . . 0.0 113.2 -175.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -144.18 164.42 29.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 125.419 1.488 . . . . 0.0 110.299 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -64.84 141.22 70.57 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 CA-C-N 120.057 1.056 . . . . 0.0 111.951 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -89.21 -25.83 21.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.931 0.892 . . . . 0.0 110.96 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 77.5 t -123.98 134.91 65.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.691 1.996 . . . . 0.0 108.324 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.3 t -132.82 145.48 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.972 0.909 . . . . 0.0 111.36 -171.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -127.0 120.13 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.377 2.671 . . . . 0.0 108.422 -169.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.2 mt -85.54 164.21 17.93 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.253 1.025 . . . . 0.0 112.058 177.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.02 -13.79 13.22 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -175.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -120.32 9.79 11.1 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.48 1.512 . . . . 0.0 113.354 -177.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.96 9.02 58.71 Favored Glycine 0 CA--C 1.533 1.212 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 174.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -75.13 136.49 41.09 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.815 1.307 . . . . 0.0 108.438 169.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.21 142.59 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.915 1.286 . . . . 0.0 109.169 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.6 p -54.02 127.31 54.04 Favored Pre-proline 0 N--CA 1.472 0.655 0 CA-C-O 118.409 -0.805 . . . . 0.0 111.232 171.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -71.34 122.78 8.98 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.535 2.157 . . . . 0.0 111.423 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.524 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 3.3 p90 -159.03 -179.27 7.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.925 2.09 . . . . 0.0 110.594 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -140.85 99.39 3.6 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 172.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.4 tp -57.73 127.93 34.53 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.369 2.268 . . . . 0.0 109.418 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -125.58 150.53 47.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.059 1.344 . . . . 0.0 110.546 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.3 mtt -133.06 144.74 50.21 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.924 1.29 . . . . 0.0 110.42 -176.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.61 147.62 43.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.32 1.448 . . . . 0.0 111.317 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -65.86 121.43 15.03 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.982 0.913 . . . . 0.0 110.506 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.62 -18.91 64.41 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 176.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -72.07 -65.51 2.35 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.611 1.1 . . . . 0.0 113.166 174.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 38.5 p -83.83 -26.1 29.8 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 83.87 -0.1 89.59 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.142 1.353 . . . . 0.0 113.874 -170.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -80.09 145.91 61.91 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-N 118.705 1.253 . . . . 0.0 112.403 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.39 151.24 80.63 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.932 2.421 . . . . 0.0 112.007 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.61 -47.47 1.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.827 1.651 . . . . 0.0 112.619 -169.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.498 HD21 HE21 ' A' ' 134' ' ' GLN . 8.0 tp -151.94 156.2 39.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.951 1.3 . . . . 0.0 109.813 -169.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.2 m -146.69 139.31 25.11 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.384 1.074 . . . . 0.0 109.149 174.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.0 131.65 56.88 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.134 1.774 . . . . 0.0 108.285 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.9 t -118.95 139.83 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.456 1.502 . . . . 0.0 111.214 -169.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.524 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 42.7 t -123.21 144.59 49.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.031 1.732 . . . . 0.0 111.255 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.0 m -129.42 8.77 5.5 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.724 1.21 . . . . 0.0 113.712 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.89 -12.8 4.47 Favored Glycine 0 CA--C 1.537 1.424 0 N-CA-C 115.71 1.044 . . . . 0.0 115.71 174.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 87.7 p -157.78 159.71 37.05 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.057 1.428 . . . . 0.0 114.128 -173.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 35.0 t-105 -60.67 139.9 92.93 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 127.068 2.147 . . . . 0.0 115.803 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -95.9 179.01 8.47 Favored 'Cis proline' 0 CA--C 1.547 1.168 0 CA-C-N 120.05 1.053 . . . . 0.0 110.828 -11.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.7 mp -72.3 165.35 24.65 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.15 -0.969 . . . . 0.0 112.251 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -118.71 129.49 55.31 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.891 1.676 . . . . 0.0 111.58 -176.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.498 HE21 HD21 ' A' ' 122' ' ' LEU . 51.7 tt0 -92.61 143.96 25.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.375 1.87 . . . . 0.0 112.582 -169.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.3 t -150.39 159.34 44.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.195 1.798 . . . . 0.0 110.924 171.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -78.85 134.45 36.94 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.366 -0.834 . . . . 0.0 109.014 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.18 60.13 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.939 2.096 . . . . 0.0 115.589 177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 39.4 ptt180 44.68 27.29 0.24 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.874 2.87 . . . . 0.0 117.405 -176.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -57.94 -30.42 65.95 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 40.7 p -79.87 -15.24 57.75 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 174.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -72.01 -39.3 6.65 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo . . . . . 0 C--O 1.25 1.103 0 C-N-CA 124.297 3.331 . . . . 0.0 115.222 176.047 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.1 tpp . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 120.296 0.093 . . . . 0.0 110.79 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -131.09 18.66 4.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.138 1.375 . . . . 0.0 113.741 -173.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -137.0 155.05 50.2 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.583 1.553 . . . . 0.0 111.827 -175.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.96 44.04 0.22 Allowed Glycine 0 CA--C 1.535 1.317 0 C-N-CA 124.343 0.973 . . . . 0.0 113.495 -172.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 28.0 ttp-105 -129.46 22.82 5.52 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.272 1.829 . . . . 0.0 112.102 -172.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -60.83 -20.85 62.45 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.448 1.499 . . . . 0.0 114.861 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -66.11 -41.9 89.93 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.044 0.937 . . . . 0.0 112.432 171.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 19.2 t -68.02 -46.83 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 118.381 -0.819 . . . . 0.0 109.409 170.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.44 -41.91 90.71 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.559 1.072 . . . . 0.0 113.028 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -61.82 -48.72 79.33 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.436 1.016 . . . . 0.0 111.818 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 m -57.66 -47.62 81.78 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.905 0.482 . . . . 0.0 111.12 176.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.72 -34.25 77.42 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.109 1.764 . . . . 0.0 112.424 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.41 ' HA ' HD11 ' A' ' 80' ' ' LEU . . . -61.82 -46.51 89.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.62 1.1 . . . . 0.0 111.534 169.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.61 -37.47 86.71 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.248 1.019 . . . . 0.0 111.663 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -65.44 -46.57 79.37 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.056 0.942 . . . . 0.0 112.238 169.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 84.8 m -60.34 -35.06 74.78 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.326 1.05 . . . . 0.0 111.803 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.55 73.4 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.025 1.33 . . . . 0.0 113.48 174.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -44.05 97.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.6 -0.687 . . . . 0.0 111.518 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -59.79 -48.54 81.28 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.6 1.16 . . . . 0.0 111.854 173.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -58.39 -44.6 89.0 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.134 0.879 . . . . 0.0 112.183 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 29.8 m -61.25 -43.03 99.55 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.493 0.588 . . . . 0.0 110.797 178.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.45 93.67 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.073 -1.017 . . . . 0.0 113.429 172.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.62 76.33 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.123 0.969 . . . . 0.0 112.779 175.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.3 tp -72.94 -34.64 66.69 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.756 1.223 . . . . 0.0 111.537 173.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.33 -45.33 93.72 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.049 -1.032 . . . . 0.0 110.833 169.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.33 -45.78 55.13 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.869 1.668 . . . . 0.0 111.178 169.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.51 96.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 178.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.91 -48.67 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.836 0.744 . . . . 0.0 110.427 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.25 -29.15 69.66 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.572 1.149 . . . . 0.0 113.167 179.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.6 ttt180 -87.01 -37.53 17.41 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.068 0.947 . . . . 0.0 113.082 177.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.22 -33.23 71.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.306 1.042 . . . . 0.0 113.623 -177.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 t -74.17 -13.87 60.87 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.6 mt -110.26 -35.96 5.94 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.373 1.469 . . . . 0.0 113.536 -173.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.3 p -70.24 -35.24 73.7 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.908 1.283 . . . . 0.0 113.703 -177.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.26 0.8 50.84 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.406 1.479 . . . . 0.0 114.699 -175.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -144.67 147.6 36.48 Favored Pre-proline 0 N--CA 1.473 0.68 0 C-N-CA 125.243 1.417 . . . . 0.0 110.08 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -46.78 152.71 1.57 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 122.608 2.205 . . . . 0.0 112.116 167.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.23 160.65 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.417 1.487 . . . . 0.0 108.455 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.66 175.97 28.57 Favored Glycine 0 CA--C 1.522 0.482 0 O-C-N 120.886 -1.134 . . . . 0.0 114.53 -176.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.4 mt -135.72 127.65 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.603 1.161 . . . . 0.0 108.728 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -99.95 130.66 46.15 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.272 1.829 . . . . 0.0 109.587 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -118.61 121.71 40.85 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.055 1.742 . . . . 0.0 107.919 176.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 p -115.34 -178.47 3.38 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.567 1.147 . . . . 0.0 113.112 -169.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -65.54 -13.54 59.15 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.2 m -139.1 -21.34 0.95 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -170.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -156.65 -172.71 4.17 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.844 1.258 . . . . 0.0 111.495 -178.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p90 -147.64 149.21 32.07 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.3 -0.875 . . . . 0.0 110.28 169.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 67.1 mtt-85 -146.86 145.63 29.92 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.289 1.435 . . . . 0.0 111.9 -171.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 14.3 mm -73.57 146.65 10.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 169.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 78.0 mtp -135.86 146.23 47.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.355 1.062 . . . . 0.0 111.483 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.9 m -140.14 165.49 30.21 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.703 1.601 . . . . 0.0 112.358 -169.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -59.79 -31.56 94.17 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 123.272 2.648 . . . . 0.0 114.642 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 45.33 -83.53 0.01 OUTLIER Glycine 0 CA--C 1.536 1.393 0 C-N-CA 127.719 2.58 . . . . 0.0 116.082 178.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -62.33 -39.56 93.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.955 1.302 . . . . 0.0 113.196 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.1 t -161.32 136.7 5.7 Favored Pre-proline 0 N--CA 1.478 0.93 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 176.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.45 -12.35 3.86 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.75 2.966 . . . . 0.0 112.995 169.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 45.4 m -70.21 -16.19 63.03 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -169.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -149.75 165.18 33.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.736 2.014 . . . . 0.0 109.556 171.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.6 t-105 -49.95 115.64 1.48 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.748 1.219 . . . . 0.0 112.002 178.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -150.55 149.89 30.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.263 1.425 . . . . 0.0 110.404 -178.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -142.18 137.9 31.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.727 0.811 . . . . 0.0 112.72 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 24.3 t -141.91 135.23 14.3 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 126.964 2.106 . . . . 0.0 108.224 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -66.86 137.61 45.69 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.868 2.378 . . . . 0.0 111.644 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.1 tp -96.47 127.16 42.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.284 0.634 . . . . 0.0 111.375 -172.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -159.96 -24.25 0.07 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 169.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.22 -18.2 46.84 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -172.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -126.78 16.61 7.45 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.634 1.574 . . . . 0.0 113.097 174.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -129.46 4.08 5.11 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.237 1.815 . . . . 0.0 113.225 176.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.55 -65.19 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 130.389 3.475 . . . . 0.0 116.552 -177.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -152.99 4.89 0.35 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.298 1.839 . . . . 0.0 113.106 -176.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.81 36.37 0.21 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.016 1.726 . . . . 0.0 113.38 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.8 t -140.35 -157.1 0.74 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.049 2.54 . . . . 0.0 108.839 -173.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 43.78 43.81 5.24 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 171.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 56.78 21.81 6.35 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 115.081 1.511 . . . . 0.0 115.081 -176.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.09 -16.35 51.66 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 118.931 -2.356 . . . . 0.0 113.918 172.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 38.5 m0 -66.05 -18.82 65.59 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -170.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -140.44 170.7 15.31 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -172.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -140.77 15.7 2.32 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 125.485 1.514 . . . . 0.0 113.392 175.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -146.27 -0.91 0.75 Allowed 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 115.274 1.583 . . . . 0.0 115.274 -169.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 13' ' ' ALA . 27.9 mt -120.58 162.63 19.31 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -168.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.6 t -139.13 131.24 28.03 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 128.442 2.697 . . . . 0.0 106.359 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -106.97 147.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 123.644 0.778 . . . . 0.0 111.183 -169.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -133.38 156.69 47.21 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.513 1.925 . . . . 0.0 109.549 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.12 162.88 31.7 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.06 0.944 . . . . 0.0 111.909 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.52 142.09 11.03 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.897 1.679 . . . . 0.0 110.002 169.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -72.59 -7.76 16.29 Favored 'Cis proline' 0 CA--C 1.546 1.083 0 CA-C-N 120.737 1.299 . . . . 0.0 113.32 -9.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -65.18 175.29 1.68 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.229 1.412 . . . . 0.0 112.073 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.58 142.28 19.0 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.254 1.022 . . . . 0.0 113.027 -174.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.33 91.71 1.11 Allowed 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 124.1 3.2 . . . . 0.0 110.826 177.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -157.38 138.45 13.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 0.0 110.272 -170.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -60.89 86.76 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.408 1.083 . . . . 0.0 112.006 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 38.7 m -95.69 -2.16 48.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.782 1.633 . . . . 0.0 113.161 -169.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.43 18.39 3.45 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 126.877 2.071 . . . . 0.0 114.449 -177.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -158.43 162.43 26.77 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 126.876 2.07 . . . . 0.0 109.348 176.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.28 152.4 75.82 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 CA-C-N 120.178 1.099 . . . . 0.0 110.441 169.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -102.85 -44.58 5.23 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.479 0.312 . . . . 0.0 110.289 170.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 58.0 t -74.85 132.8 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.864 0.866 . . . . 0.0 109.183 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 99.2 t -134.37 144.81 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.814 0.846 . . . . 0.0 110.796 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.4 mp -130.45 122.31 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 127.749 2.42 . . . . 0.0 109.46 -169.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.2 mt -87.92 159.75 18.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.997 0.904 . . . . 0.0 111.623 174.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.05 -27.57 63.71 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.127 1.371 . . . . 0.0 114.509 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -84.74 -5.18 59.31 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.088 1.355 . . . . 0.0 113.431 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 90.39 12.14 61.7 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.217 0.913 . . . . 0.0 114.61 -176.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -76.89 136.38 38.84 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 118.482 1.141 . . . . 0.0 108.734 169.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -130.01 148.32 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.054 1.341 . . . . 0.0 109.431 -172.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 p -51.49 124.06 24.01 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.047 0.939 . . . . 0.0 111.908 169.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -74.03 92.69 0.89 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.151 2.567 . . . . 0.0 111.6 177.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -134.34 -178.09 4.89 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.258 1.823 . . . . 0.0 112.093 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 m -141.68 147.63 37.79 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.665 0.786 . . . . 0.0 111.259 169.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.5 133.01 52.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.993 2.117 . . . . 0.0 108.438 -176.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.6 tt -122.14 147.19 46.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.119 -176.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 52.3 mtt -123.85 129.5 51.11 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 124.983 1.313 . . . . 0.0 109.761 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.9 143.6 51.23 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.896 1.678 . . . . 0.0 111.061 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 35.3 t-20 -53.49 124.18 14.15 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.525 1.13 . . . . 0.0 111.566 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.54 -20.6 56.75 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -112.07 -48.62 0.65 Allowed Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.773 1.177 . . . . 0.0 113.214 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.8 m -71.87 -22.02 61.58 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.13 0.965 . . . . 0.0 112.288 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 68.14 35.86 84.26 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.235 0.921 . . . . 0.0 113.49 177.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -133.06 132.72 22.48 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.422 1.489 . . . . 0.0 110.887 -169.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -53.11 145.06 44.32 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 124.051 3.167 . . . . 0.0 115.0 177.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -34.08 4.09 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.736 1.215 . . . . 0.0 111.44 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -154.4 157.58 38.74 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.216 1.006 . . . . 0.0 111.997 -168.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 7.4 m -143.94 147.8 34.46 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.301 1.84 . . . . 0.0 109.403 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.6 mp -119.42 142.17 48.45 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 126.161 1.785 . . . . 0.0 108.784 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 40.0 t -135.11 134.4 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.665 0.786 . . . . 0.0 111.702 -169.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 13.5 t -108.86 161.29 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.958 1.303 . . . . 0.0 112.137 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.5 p -133.78 2.07 3.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.885 1.674 . . . . 0.0 113.766 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 121.56 -8.82 10.1 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.121 1.343 . . . . 0.0 114.503 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.4 p -155.65 159.38 39.54 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 118.59 1.195 . . . . 0.0 113.75 -174.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.8 t-105 -60.9 138.73 93.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.852 2.061 . . . . 0.0 115.732 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.6 175.55 10.3 Favored 'Cis proline' 0 CA--C 1.546 1.11 0 CA-C-N 119.926 1.009 . . . . 0.0 110.717 -11.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.0 154.31 42.11 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 122.203 1.001 . . . . 0.0 110.718 169.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -79.05 168.11 20.12 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.311 1.445 . . . . 0.0 109.047 169.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -144.42 130.63 19.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.546 1.538 . . . . 0.0 109.968 -177.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.3 t -151.83 160.83 43.42 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.956 1.302 . . . . 0.0 112.173 -171.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.33 131.09 35.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.412 -0.805 . . . . 0.0 109.142 169.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.27 61.08 0.55 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.203 1.801 . . . . 0.0 115.541 173.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 57.29 12.37 1.37 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 127.997 2.519 . . . . 0.0 117.291 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -55.63 -35.05 65.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.575 2.065 . . . . 0.0 116.575 -169.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -80.59 -15.64 56.13 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -66.65 133.93 94.23 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.075 0.95 . . . . 0.0 112.182 -169.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo . . . . . 0 C--O 1.249 1.062 0 C-N-CA 123.446 2.764 . . . . 0.0 113.17 178.334 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.76 146.1 32.88 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.431 1.092 . . . . 0.0 111.063 171.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -68.88 -18.75 64.18 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -150.74 155.2 26.04 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 126.524 2.012 . . . . 0.0 109.974 170.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 66.5 mtt85 -71.22 81.11 0.72 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.624 1.57 . . . . 0.0 113.013 -169.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -52.57 -34.28 49.7 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -173.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -72.82 -38.36 67.18 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.985 -1.072 . . . . 0.0 113.033 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.83 -38.9 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.94 170.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.73 -44.03 97.27 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.317 0.962 . . . . 0.0 112.422 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -57.75 -46.33 84.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.085 1.311 . . . . 0.0 111.843 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.8 m -61.41 -57.11 13.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.615 0.766 . . . . 0.0 111.255 178.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -63.11 -34.39 77.51 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.145 1.378 . . . . 0.0 113.076 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.65 -52.76 63.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 120.692 1.587 . . . . 0.0 111.719 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -64.22 -41.87 96.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.93 -54.25 44.49 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.307 1.443 . . . . 0.0 112.417 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 94.3 m -60.6 -36.43 78.55 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.892 1.277 . . . . 0.0 111.414 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.91 86.9 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.12 -42.5 99.29 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.433 -0.792 . . . . 0.0 111.915 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.0 ttm180 -61.39 -46.32 90.67 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.622 1.169 . . . . 0.0 111.858 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -62.73 -41.42 99.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.473 0.709 . . . . 0.0 112.107 173.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 45.1 m -59.38 -41.55 89.59 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.1 0.863 . . . . 0.0 111.322 175.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -40.65 96.05 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.77 -1.206 . . . . 0.0 113.399 172.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.68 -30.98 71.75 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 121.144 -0.972 . . . . 0.0 113.234 174.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.0 tp -72.1 -34.52 68.7 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.39 1.076 . . . . 0.0 111.84 172.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.18 -46.11 90.39 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.058 -1.026 . . . . 0.0 111.467 169.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.9 tp -53.98 -46.83 71.81 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.082 1.353 . . . . 0.0 111.982 170.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.45 -43.67 88.92 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 175.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.33 -46.62 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.805 0.842 . . . . 0.0 110.981 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -31.28 69.54 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.924 0.89 . . . . 0.0 112.931 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.9 mtt-85 -80.28 -37.98 31.73 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.24 1.016 . . . . 0.0 113.483 172.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.93 -34.47 78.18 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.524 1.056 . . . . 0.0 113.369 -175.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.1 t -70.29 -20.18 63.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.94 -31.25 9.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.199 1.4 . . . . 0.0 114.336 -174.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.7 m -82.13 -14.19 56.09 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.81 -3.94 81.51 Favored Glycine 0 CA--C 1.54 1.632 0 C-N-CA 124.22 0.914 . . . . 0.0 115.069 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -139.99 151.84 66.21 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 128.399 2.68 . . . . 0.0 106.765 170.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -45.63 166.65 0.06 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.358 3.372 . . . . 0.0 115.871 169.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -123.22 161.22 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 126.283 1.833 . . . . 0.0 108.235 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -165.28 -175.56 36.04 Favored Glycine 0 N--CA 1.469 0.889 0 CA-C-N 120.698 1.59 . . . . 0.0 115.964 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.8 mp -127.41 122.54 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.783 1.233 . . . . 0.0 110.886 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -83.4 68.88 9.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.346 1.858 . . . . 0.0 111.322 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -59.65 119.95 8.56 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.466 -0.771 . . . . 0.0 110.219 169.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 84.1 p -141.33 13.52 2.18 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -169.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.76 -47.28 0.26 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.693 2.797 . . . . 0.0 115.169 -174.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.7 m -69.27 -26.95 65.01 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.63 1.172 . . . . 0.0 112.611 171.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.47 166.63 31.73 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.425 1.89 . . . . 0.0 111.043 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -155.96 99.39 1.97 Allowed 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.915 -0.491 . . . . 0.0 111.558 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -142.42 161.69 37.39 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -169.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.1 mm -71.47 142.52 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.528 1.131 . . . . 0.0 111.213 -171.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 81.0 mtp -128.4 146.67 50.72 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.796 1.638 . . . . 0.0 110.17 169.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 m -133.7 158.86 74.52 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 125.922 1.689 . . . . 0.0 111.26 -170.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -52.39 144.84 38.66 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.417 2.745 . . . . 0.0 115.503 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -101.62 -151.24 24.31 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 125.513 1.53 . . . . 0.0 113.087 175.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -55.42 -23.7 26.36 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.2 p -133.27 65.5 72.93 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 119.44 1.018 . . . . 0.0 113.204 -169.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -63.09 -17.19 58.93 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 123.04 2.493 . . . . 0.0 113.272 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -59.59 -15.36 18.14 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.427 1.491 . . . . 0.0 114.008 169.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.85 -87.39 0.2 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.62 1.168 . . . . 0.0 111.947 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -162.88 110.08 1.23 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.435 1.094 . . . . 0.0 111.874 -171.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.58 151.29 29.59 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.211 1.004 . . . . 0.0 110.11 169.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -138.69 150.5 46.26 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -171.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.8 t -143.4 138.96 15.96 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 126.957 2.103 . . . . 0.0 108.686 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -63.93 145.82 90.63 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.592 2.194 . . . . 0.0 111.304 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.1 tp -74.42 45.46 0.23 Allowed 'General case' 0 CA--C 1.555 1.17 0 N-CA-C 115.011 1.485 . . . . 0.0 115.011 -170.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -58.01 -20.76 41.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 119.635 -1.915 . . . . 0.0 113.841 172.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -59.42 -18.84 42.56 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.245 1.018 . . . . 0.0 113.686 172.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -130.69 -35.27 1.47 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.2 1.0 . . . . 0.0 113.498 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.13 -8.19 59.29 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 177.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.14 -60.29 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 129.436 3.095 . . . . 0.0 116.158 -173.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -148.03 -0.55 0.6 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.431 1.892 . . . . 0.0 112.898 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -92.23 0.49 57.46 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.674 -1.266 . . . . 0.0 113.415 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.2 p -64.57 13.89 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 128.456 2.702 . . . . 0.0 117.28 -172.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -154.44 42.82 0.51 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.557 1.543 . . . . 0.0 111.717 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -136.59 163.2 31.09 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.562 1.545 . . . . 0.0 112.878 -173.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -72.7 -177.42 2.3 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.782 0.833 . . . . 0.0 110.78 168.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -120.45 -6.83 9.77 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -150.64 -168.66 3.17 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -168.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -125.22 2.67 7.85 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.458 1.903 . . . . 0.0 114.382 -175.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -150.12 -4.33 0.36 Allowed 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -169.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.4 mt -105.84 167.91 9.47 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.707 -1.246 . . . . 0.0 113.139 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.7 t -140.76 136.59 32.68 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 127.427 2.291 . . . . 0.0 107.83 169.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -109.72 145.36 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.47 1.108 . . . . 0.0 111.272 -169.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -137.76 157.56 46.19 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.239 1.816 . . . . 0.0 110.142 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.508 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.8 tt -151.22 146.01 25.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.9 0.88 . . . . 0.0 112.089 -171.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.508 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.2 pm0 -151.69 150.88 27.44 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.579 1.552 . . . . 0.0 111.125 169.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -80.04 -13.12 35.62 Favored 'Cis proline' 0 CA--C 1.543 0.943 0 CA-C-N 120.198 1.107 . . . . 0.0 114.451 -0.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -64.19 144.23 57.29 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.948 0.88 . . . . 0.0 113.234 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -62.49 128.87 92.08 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.539 1.536 . . . . 0.0 112.008 170.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -82.59 57.58 6.15 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 123.768 2.979 . . . . 0.0 109.673 169.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.39 150.0 26.45 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.039 1.336 . . . . 0.0 113.369 -169.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -74.17 47.98 0.3 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.859 1.664 . . . . 0.0 112.579 173.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.1 m -67.96 -5.59 17.9 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.942 1.697 . . . . 0.0 115.383 -172.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 56.31 27.83 12.47 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 126.157 1.783 . . . . 0.0 113.516 -174.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -146.9 163.12 30.42 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.848 2.059 . . . . 0.0 109.3 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -65.75 147.54 85.79 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 CA-C-N 120.085 1.066 . . . . 0.0 111.867 169.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 -95.3 -50.47 5.01 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.686 1.194 . . . . 0.0 109.806 170.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 68.3 t -89.66 136.4 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 125.371 1.468 . . . . 0.0 108.15 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 48.8 t -135.16 143.57 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-O 122.147 0.975 . . . . 0.0 111.947 -171.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -117.19 111.03 33.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 128.582 2.753 . . . . 0.0 107.639 -176.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.15 153.07 36.48 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.134 0.973 . . . . 0.0 109.81 177.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.82 -21.93 44.94 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.28 -11.4 59.9 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.275 1.43 . . . . 0.0 113.573 176.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.48 42.67 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.499 1.047 . . . . 0.0 114.187 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.69 147.44 29.58 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.981 1.312 . . . . 0.0 108.103 173.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -121.97 150.88 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.693 0.797 . . . . 0.0 110.585 -168.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.3 p -56.78 130.52 78.18 Favored Pre-proline 0 CA--C 1.541 0.62 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.693 169.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -74.97 134.08 17.42 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.34 2.027 . . . . 0.0 112.201 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.461 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 14.5 p90 -163.92 177.28 8.68 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.693 1.997 . . . . 0.0 111.346 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.4 p -138.54 148.49 44.31 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.015 0.912 . . . . 0.0 110.646 169.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 tp -135.81 130.19 33.6 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 126.835 2.054 . . . . 0.0 108.089 -169.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -121.2 150.25 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 125.007 1.323 . . . . 0.0 110.363 -173.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 55.3 mtt -127.53 139.66 52.63 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 125.561 1.545 . . . . 0.0 108.669 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -136.83 151.39 49.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.293 1.437 . . . . 0.0 111.11 -177.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -61.73 119.8 9.41 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.365 1.066 . . . . 0.0 109.685 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.1 -19.4 61.42 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -174.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -101.66 -45.02 1.86 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 124.073 0.844 . . . . 0.0 113.609 -177.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.6 p -80.29 -27.82 38.42 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.707 1.254 . . . . 0.0 112.858 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 79.75 0.86 85.99 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 125.119 1.342 . . . . 0.0 113.928 -172.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -75.9 138.42 69.45 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 118.564 1.182 . . . . 0.0 111.638 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -65.25 154.59 72.86 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.566 2.177 . . . . 0.0 111.798 175.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -129.25 -51.32 1.19 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.983 1.713 . . . . 0.0 112.06 -169.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.82 153.12 40.55 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 126.847 2.059 . . . . 0.0 108.426 -169.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 4.9 m -143.97 136.84 27.28 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.539 0.736 . . . . 0.0 109.506 172.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.1 mp -116.55 143.78 45.18 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.819 2.448 . . . . 0.0 108.096 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 24.0 t -141.44 134.1 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.901 0.48 . . . . 0.0 111.911 -171.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.461 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 47.7 t -112.72 114.64 27.31 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.943 1.697 . . . . 0.0 110.305 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 65.4 p -75.34 -13.2 60.4 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.935 1.294 . . . . 0.0 114.296 174.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 128.21 0.62 6.36 Favored Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.414 1.483 . . . . 0.0 114.339 -175.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 19.5 m -156.56 156.06 32.97 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.428 -1.631 . . . . 0.0 112.996 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 30.3 t-105 -60.09 140.15 90.87 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 125.939 1.696 . . . . 0.0 115.344 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -94.29 176.55 12.33 Favored 'Cis proline' 0 CA--C 1.546 1.089 0 CA-C-N 119.932 1.011 . . . . 0.0 110.751 -11.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.1 mp -67.87 149.52 49.73 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.069 -1.019 . . . . 0.0 110.746 169.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -77.87 170.7 16.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.982 1.313 . . . . 0.0 110.282 170.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -140.01 144.45 36.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.781 1.632 . . . . 0.0 111.394 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.7 t -153.42 151.55 30.02 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.889 1.275 . . . . 0.0 111.7 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.88 134.22 50.48 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.588 -0.695 . . . . 0.0 109.841 170.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.68 67.87 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 127.423 2.289 . . . . 0.0 116.579 171.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 27.3 mtm105 55.7 19.65 3.51 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.27 -17.52 12.24 Favored 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -177.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 8.3 t -134.09 28.34 3.8 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.022 1.329 . . . . 0.0 113.334 169.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.66 71.23 71.03 Favored Pre-proline 0 N--CA 1.481 1.12 0 C-N-CA 125.282 1.433 . . . . 0.0 110.677 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo . . . . . 0 C--O 1.251 1.167 1 C-N-CA 125.507 4.138 . . . . 0.0 116.048 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.487 1.418 0 N-CA-C 110.669 -0.122 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.51 161.68 39.19 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.754 1.222 . . . . 0.0 112.091 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -61.57 -25.4 67.3 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.013 1.725 . . . . 0.0 114.687 -172.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -171.71 162.97 35.46 Favored Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.416 1.484 . . . . 0.0 111.89 174.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 52.59 19.07 1.11 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 126.005 1.722 . . . . 0.0 114.734 -175.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -56.36 -38.51 71.5 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 -169.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.58 -40.13 80.66 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.107 0.867 . . . . 0.0 112.316 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 35.4 t -69.46 -46.4 76.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.253 0.621 . . . . 0.0 109.957 174.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.22 87.38 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.731 0.696 . . . . 0.0 112.37 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -63.63 -46.42 85.76 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.204 0.911 . . . . 0.0 112.219 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 89.6 m -56.72 -49.77 74.19 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.932 175.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -67.47 -28.57 67.97 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.001 -1.0 . . . . 0.0 113.615 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.52 -48.09 78.99 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 120.711 1.596 . . . . 0.0 111.37 171.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -67.74 -40.64 84.14 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.829 1.252 . . . . 0.0 111.431 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.75 -38.65 80.28 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.697 0.799 . . . . 0.0 113.038 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.5 m -69.71 -34.44 73.9 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 120.117 -1.614 . . . . 0.0 111.853 175.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.1 -45.65 91.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 170.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.29 92.94 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 112.06 173.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -64.49 -45.08 88.84 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.016 0.926 . . . . 0.0 112.328 178.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -62.76 -40.35 97.0 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.195 0.598 . . . . 0.0 112.342 174.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 39.1 m -60.86 -44.08 97.49 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.796 0.726 . . . . 0.0 110.795 175.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.75 98.29 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.686 -1.259 . . . . 0.0 113.391 172.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.49 76.15 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.14 -0.975 . . . . 0.0 113.097 175.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.1 tp -73.13 -31.74 64.48 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.439 1.095 . . . . 0.0 111.818 173.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -62.97 -44.31 96.39 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.935 -1.103 . . . . 0.0 110.864 169.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.15 -44.64 67.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.376 1.47 . . . . 0.0 111.321 169.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.28 97.15 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.2 mt -64.14 -45.0 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.202 1.001 . . . . 0.0 111.099 174.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.43 -43.52 75.44 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.803 0.841 . . . . 0.0 112.1 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.73 -31.77 61.92 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 178.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.8 89.7 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.414 1.007 . . . . 0.0 113.191 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.9 t -76.08 -24.26 55.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -95.12 -31.11 13.7 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -174.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 92.2 p -89.5 -14.52 35.07 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -169.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.23 6.53 78.27 Favored Glycine 0 CA--C 1.539 1.549 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 170.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.62 151.71 54.51 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.987 2.115 . . . . 0.0 107.596 169.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -46.88 149.31 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 121.98 1.787 . . . . 0.0 111.652 167.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.19 164.93 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.323 1.849 . . . . 0.0 108.486 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.29 -178.68 30.68 Favored Glycine 0 C--N 1.332 0.308 0 O-C-N 120.762 -1.211 . . . . 0.0 115.404 -174.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.6 mt -135.6 120.88 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.564 1.146 . . . . 0.0 108.543 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -89.97 141.89 28.23 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 126.156 1.783 . . . . 0.0 110.861 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -140.07 130.23 25.06 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 126.137 1.775 . . . . 0.0 109.449 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.2 t -132.55 179.66 6.0 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.233 1.413 . . . . 0.0 111.039 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -61.85 -14.95 38.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -169.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 -8.42 0.92 Allowed 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 -178.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.5 164.52 36.08 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.778 1.172 . . . . 0.0 113.248 -177.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -149.67 156.22 41.52 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.269 1.828 . . . . 0.0 112.006 -175.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -161.26 148.0 14.73 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.727 1.611 . . . . 0.0 111.342 -175.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.9 mm -68.23 147.68 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 124.411 1.085 . . . . 0.0 109.566 172.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 44.7 mtp -135.75 150.67 49.58 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 120.474 -1.391 . . . . 0.0 112.466 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 9.4 m -144.06 168.03 13.67 Favored Pre-proline 0 N--CA 1.478 0.969 0 C-N-CA 126.219 1.808 . . . . 0.0 111.736 -169.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -57.53 -33.74 96.95 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.821 2.347 . . . . 0.0 114.089 171.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.46 -50.27 0.61 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 127.47 2.462 . . . . 0.0 116.673 170.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -137.72 -26.52 0.96 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.342 1.457 . . . . 0.0 114.578 -170.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.0 t -148.84 74.94 10.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 123.8 0.84 . . . . 0.0 112.646 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -63.35 -11.5 25.92 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 122.996 2.464 . . . . 0.0 113.624 170.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.2 m -60.08 -16.89 35.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.538 1.935 . . . . 0.0 114.662 172.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -147.01 171.01 15.92 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.133 1.773 . . . . 0.0 110.472 175.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 53.3 t-105 -62.8 112.39 2.52 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.366 -0.834 . . . . 0.0 111.145 173.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.457 ' NE ' ' H ' ' A' ' 61' ' ' TRP . 4.6 tpm_? -150.65 157.29 42.8 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.852 1.261 . . . . 0.0 110.98 174.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.457 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 85.4 m95 -139.19 138.46 36.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.207 1.403 . . . . 0.0 111.945 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.77 138.86 17.57 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 126.966 2.106 . . . . 0.0 107.795 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.08 128.74 22.49 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.84 2.36 . . . . 0.0 111.183 175.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.3 tp -76.17 78.8 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.366 1.066 . . . . 0.0 111.133 -176.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -91.3 5.46 49.12 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.32 1.048 . . . . 0.0 112.24 171.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -50.11 110.54 0.41 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.728 2.011 . . . . 0.0 111.966 173.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.0 t70 57.95 -29.71 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.533 2.733 . . . . 0.0 116.385 -171.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 72' ' ' SER . . . -68.38 -18.29 64.43 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.346 1.859 . . . . 0.0 113.644 175.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.73 -178.01 0.14 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.329 2.652 . . . . 0.0 115.653 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -72.8 23.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.967 1.707 . . . . 0.0 114.619 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -128.31 7.18 5.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.896 2.078 . . . . 0.0 111.216 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.401 ' HB3' ' HB1' ' A' ' 68' ' ' ALA . 73.3 p -79.83 -23.53 41.96 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.357 1.463 . . . . 0.0 114.084 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -74.08 123.19 23.93 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.248 1.019 . . . . 0.0 109.207 169.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -147.43 -179.48 6.88 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.098 0.959 . . . . 0.0 112.801 -169.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.91 25.51 10.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.05 2.14 . . . . 0.0 112.579 -177.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER 58.17 -44.66 0.05 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 130.131 3.372 . . . . 0.0 118.413 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -156.55 -167.91 2.54 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.334 0.97 . . . . 0.0 113.409 -169.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -128.09 -14.14 4.97 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.785 2.034 . . . . 0.0 113.121 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -120.42 5.03 10.69 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.59 1.556 . . . . 0.0 111.904 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -139.26 141.63 37.81 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.531 1.532 . . . . 0.0 110.064 -169.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 88.9 p -137.14 154.91 50.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.678 1.991 . . . . 0.0 111.39 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.7 mp -116.07 147.6 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.107 1.363 . . . . 0.0 112.173 -169.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -139.68 162.28 35.49 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.898 2.079 . . . . 0.0 110.838 170.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.2 mt -141.14 155.95 46.02 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.592 1.157 . . . . 0.0 113.932 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.69 155.14 22.18 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.893 2.077 . . . . 0.0 110.325 169.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.13 -9.16 18.38 Favored 'Cis proline' 0 CA--C 1.544 1.008 0 CA-C-N 120.469 1.203 . . . . 0.0 113.207 -9.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.16 172.01 1.59 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.613 1.565 . . . . 0.0 113.361 173.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -126.31 121.66 23.81 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.368 1.867 . . . . 0.0 110.932 -170.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.5 98.3 0.94 Allowed 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.698 2.265 . . . . 0.0 110.475 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -154.35 157.23 38.27 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.483 1.513 . . . . 0.0 111.301 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -70.52 47.0 0.09 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 128.219 2.608 . . . . 0.0 114.358 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.6 t -65.05 160.96 19.8 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.101 2.16 . . . . 0.0 114.303 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -63.81 -13.79 47.4 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.628 1.571 . . . . 0.0 112.727 169.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -131.04 162.78 53.52 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.271 1.428 . . . . 0.0 112.571 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -70.81 164.56 35.13 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.179 2.586 . . . . 0.0 112.416 169.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -95.57 -21.94 17.94 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.619 1.568 . . . . 0.0 112.398 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.1 t -114.11 143.26 24.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.547 1.139 . . . . 0.0 108.875 169.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 62.2 t -136.18 137.75 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 110.326 -178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -125.25 117.97 51.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 128.679 2.791 . . . . 0.0 106.925 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.15 148.58 35.89 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.385 0.612 . . . . 0.0 110.224 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.9 -22.79 60.16 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -70.02 -22.82 63.07 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.08 1.752 . . . . 0.0 113.458 173.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 104.09 5.13 44.17 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.98 1.276 . . . . 0.0 115.056 -179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.554 ' C ' HD12 ' A' ' 105' ' ' ILE . 9.1 pt20 -90.55 154.53 19.54 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.81 1.644 . . . . 0.0 109.869 169.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.554 HD12 ' C ' ' A' ' 104' ' ' GLN . 1.2 mp -129.76 142.7 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 124.696 1.198 . . . . 0.0 109.605 -169.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t -56.17 140.43 70.98 Favored Pre-proline 0 N--CA 1.477 0.875 0 C-N-CA 123.541 0.736 . . . . 0.0 112.642 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -64.73 131.18 28.45 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.765 2.31 . . . . 0.0 112.601 169.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.435 ' CZ ' HD21 ' A' ' 132' ' ' LEU . 26.1 p90 -161.52 173.57 14.63 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.785 1.634 . . . . 0.0 111.364 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.3 t -134.28 135.55 42.94 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.07 0.948 . . . . 0.0 110.194 169.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.1 tp -128.64 116.0 18.92 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 128.06 2.544 . . . . 0.0 108.467 -169.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -105.35 147.06 28.58 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 124.752 1.221 . . . . 0.0 110.444 -173.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 51.1 mtt -128.38 130.56 47.86 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.849 1.66 . . . . 0.0 109.753 -176.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -134.26 152.29 51.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.773 1.229 . . . . 0.0 112.29 -169.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -64.93 110.4 2.43 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.116 1.367 . . . . 0.0 110.528 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.56 -15.83 59.12 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -83.69 -20.49 59.75 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.721 1.153 . . . . 0.0 114.384 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -132.03 -21.28 2.4 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.987 1.393 . . . . 0.0 114.424 -171.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 86.78 -1.09 86.88 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 125.599 1.571 . . . . 0.0 114.4 -176.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -83.97 131.51 51.2 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.583 1.191 . . . . 0.0 112.517 -171.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -52.01 143.47 40.48 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.531 2.821 . . . . 0.0 113.568 169.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.11 -44.66 1.15 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.686 1.594 . . . . 0.0 112.151 -172.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.2 tt -149.94 155.21 39.58 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 125.833 1.653 . . . . 0.0 108.172 -178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 85.5 m -144.04 151.11 39.23 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.233 -1.542 . . . . 0.0 109.505 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 78.1 mt -128.11 133.59 49.03 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 127.295 2.238 . . . . 0.0 108.323 -169.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 20.5 t -133.58 135.92 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 122.982 0.513 . . . . 0.0 111.995 -169.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 34.0 t -119.41 141.0 49.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.945 1.698 . . . . 0.0 110.443 175.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -127.94 2.28 5.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.193 1.397 . . . . 0.0 113.833 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 152.59 -20.14 0.8 Allowed Glycine 0 CA--C 1.535 1.317 0 N-CA-C 115.852 1.101 . . . . 0.0 115.852 175.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 4.9 t -156.26 165.27 36.87 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.771 1.785 . . . . 0.0 114.345 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 16.2 t-105 -63.86 143.66 98.1 Favored Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 127.738 2.415 . . . . 0.0 115.333 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -91.44 177.26 15.84 Favored 'Cis proline' 0 CA--C 1.546 1.102 0 CA-C-N 119.479 0.85 . . . . 0.0 110.472 -11.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.435 HD21 ' CZ ' ' A' ' 108' ' ' PHE . 6.6 mp -68.3 156.26 38.07 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.061 -1.024 . . . . 0.0 111.66 169.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -101.98 129.02 48.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.445 1.498 . . . . 0.0 110.858 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -84.58 149.62 25.76 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.844 1.258 . . . . 0.0 112.048 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 13.0 t -149.77 146.17 27.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.028 1.731 . . . . 0.0 109.623 169.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.28 136.49 42.64 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.097 -1.002 . . . . 0.0 109.814 170.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 61.07 0.11 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.365 2.266 . . . . 0.0 115.427 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.266 11.6 ptm180 44.7 27.95 0.3 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.128 2.571 . . . . 0.0 117.763 -176.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -55.76 -34.57 65.33 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.14 -4.1 58.56 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 174.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.37 48.67 0.51 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.25 1.42 . . . . 0.0 114.612 -170.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo . . . . . 0 C--O 1.249 1.058 0 C-N-CA 123.501 2.8 . . . . 0.0 113.173 179.555 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 ttp . . . . . 0 N--CA 1.489 1.485 0 N-CA-C 110.456 -0.202 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.3 170.69 17.94 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.085 1.354 . . . . 0.0 111.775 179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -127.89 5.79 6.02 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.125 1.77 . . . . 0.0 112.537 -175.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -148.15 157.19 27.24 Favored Glycine 0 CA--C 1.531 1.082 0 C-N-CA 127.785 2.612 . . . . 0.0 108.625 169.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -69.8 86.54 0.5 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.323 1.049 . . . . 0.0 113.701 -169.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -54.05 -26.19 25.4 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 171.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -76.92 -3.72 40.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.035 1.334 . . . . 0.0 114.425 175.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.3 t -129.54 -35.67 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 126.021 1.729 . . . . 0.0 111.696 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.64 73.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.719 1.208 . . . . 0.0 113.563 -173.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -60.01 -52.31 65.92 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.591 1.087 . . . . 0.0 111.919 174.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.9 m -60.08 -44.45 94.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.985 0.914 . . . . 0.0 111.386 177.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -33.92 76.11 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.268 1.027 . . . . 0.0 112.866 178.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.07 -48.78 78.7 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.872 1.215 . . . . 0.0 111.302 170.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -62.47 -38.34 89.47 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.523 1.129 . . . . 0.0 111.913 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -64.22 -50.34 68.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.09 1.356 . . . . 0.0 111.932 170.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 85.8 m -62.52 -32.94 73.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.549 1.14 . . . . 0.0 111.389 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.8 80.22 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.596 1.158 . . . . 0.0 113.292 170.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.3 95.29 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.462 -0.774 . . . . 0.0 111.736 173.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -60.99 -47.37 86.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.111 1.364 . . . . 0.0 112.058 176.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.59 -42.2 98.52 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.698 0.799 . . . . 0.0 112.458 171.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 59.6 m -59.29 -40.79 87.26 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.558 -0.714 . . . . 0.0 111.283 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.99 92.52 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.808 -1.183 . . . . 0.0 113.374 172.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.19 -33.73 76.45 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.202 -0.936 . . . . 0.0 112.915 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -70.37 -35.26 73.43 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.554 1.142 . . . . 0.0 112.147 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.62 -44.32 96.58 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.076 -1.015 . . . . 0.0 111.723 170.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.2 tp -54.11 -46.48 72.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.148 1.379 . . . . 0.0 111.534 170.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.02 96.26 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.3 mt -62.51 -46.53 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.261 0.937 . . . . 0.0 110.806 173.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.38 -36.59 78.42 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.463 0.705 . . . . 0.0 112.599 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -73.69 -30.67 63.02 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.04 0.936 . . . . 0.0 113.14 174.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.05 -39.77 90.41 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 119.971 1.259 . . . . 0.0 114.083 -176.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -68.23 -29.04 67.77 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.675 -0.641 . . . . 0.0 112.121 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.1 mt -79.87 -33.77 39.75 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.025 1.33 . . . . 0.0 113.055 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.8 m -75.39 -22.57 57.36 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -173.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.89 9.79 71.37 Favored Glycine 0 CA--C 1.541 1.706 0 C-N-CA 123.74 0.686 . . . . 0.0 114.434 -176.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -151.15 150.64 27.79 Favored Pre-proline 0 CA--C 1.539 0.528 0 C-N-CA 128.402 2.681 . . . . 0.0 107.592 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -47.66 149.95 4.5 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.508 2.139 . . . . 0.0 112.741 168.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -116.17 165.31 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 126.913 2.085 . . . . 0.0 108.714 -175.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -150.59 175.42 29.62 Favored Glycine 0 CA--C 1.52 0.371 0 O-C-N 121.024 -1.047 . . . . 0.0 115.508 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 40.6 mt -132.67 120.1 40.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 124.858 1.263 . . . . 0.0 108.316 178.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -81.86 146.03 30.06 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.306 1.442 . . . . 0.0 110.771 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -142.35 138.3 31.13 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.461 1.905 . . . . 0.0 110.587 174.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.8 p -129.6 -177.61 4.34 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.661 1.584 . . . . 0.0 112.09 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.09 -15.6 14.87 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.171 1.175 . . . . 0.0 114.171 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.1 p -142.61 -11.06 0.81 Allowed 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.466 2.025 . . . . 0.0 116.466 -172.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -150.73 172.13 16.06 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.117 1.326 . . . . 0.0 113.816 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -141.72 158.61 43.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.136 1.774 . . . . 0.0 110.849 171.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -158.51 161.92 37.41 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 124.064 0.945 . . . . 0.0 112.916 169.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.7 mm -80.08 145.05 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.563 1.145 . . . . 0.0 108.849 169.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 70.2 mtp -135.81 143.38 45.14 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.209 1.003 . . . . 0.0 111.636 175.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.9 m -143.45 166.25 20.92 Favored Pre-proline 0 N--CA 1.483 1.192 0 C-N-CA 126.223 1.809 . . . . 0.0 111.177 -169.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.63 163.4 24.49 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.725 2.284 . . . . 0.0 113.285 171.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.41 -84.37 0.09 OUTLIER Glycine 0 N--CA 1.472 1.059 0 C-N-CA 123.86 0.743 . . . . 0.0 114.292 176.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 10.8 mmpt? -61.41 -31.31 71.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.712 0.805 . . . . 0.0 113.013 -176.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.7 t -158.0 140.67 10.6 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 124.456 1.103 . . . . 0.0 111.37 169.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -81.93 5.17 6.49 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 124.055 3.17 . . . . 0.0 112.52 169.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 64.2 m -62.56 -27.9 69.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -171.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -159.58 -49.74 0.05 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -175.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -148.23 -74.93 0.18 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -169.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -8.64 83.02 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 129.261 3.024 . . . . 0.0 116.454 -169.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -66.3 161.02 23.27 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.486 1.514 . . . . 0.0 114.693 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 41.4 t -140.36 142.34 29.16 Favored Pre-proline 0 N--CA 1.47 0.525 0 C-N-CA 128.262 2.625 . . . . 0.0 107.626 174.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.6 43.15 0.63 Allowed 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 124.854 3.702 . . . . 0.0 113.172 173.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 43.6 tp 52.92 -90.01 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.395 2.678 . . . . 0.0 112.665 -169.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 51.31 12.96 0.16 Allowed 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -66.61 -23.39 66.17 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.64 -1.287 . . . . 0.0 113.394 173.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -141.02 -38.96 0.41 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.753 1.621 . . . . 0.0 111.411 172.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 40.06 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.337 1.855 . . . . 0.0 112.579 169.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -44.88 -25.04 0.26 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 128.982 2.913 . . . . 0.0 118.787 -168.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -140.48 18.5 2.38 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.923 1.289 . . . . 0.0 111.76 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -146.03 18.38 1.42 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.756 1.223 . . . . 0.0 114.256 -169.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.4 p -68.28 -35.48 77.92 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.911 -1.118 . . . . 0.0 112.539 171.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -68.92 119.45 13.27 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.177 1.391 . . . . 0.0 111.229 170.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -138.14 179.94 6.15 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.009 1.724 . . . . 0.0 111.249 -170.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -136.91 178.74 6.84 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.817 2.047 . . . . 0.0 110.127 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -144.03 -46.79 0.27 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -67.42 163.24 21.29 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -169.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -143.03 -17.67 0.66 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.115 1.366 . . . . 0.0 114.445 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -132.06 14.87 4.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.649 1.58 . . . . 0.0 112.317 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.5 mt -118.87 162.42 18.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.538 1.135 . . . . 0.0 113.613 -175.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.8 t -138.23 133.87 33.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 128.008 2.523 . . . . 0.0 107.385 169.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -108.21 144.05 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 111.081 -169.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -137.79 149.78 46.67 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.99 1.716 . . . . 0.0 110.226 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.6 mt -126.72 151.82 47.65 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.419 1.088 . . . . 0.0 112.069 -172.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -143.61 128.0 9.45 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.654 1.582 . . . . 0.0 110.016 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -79.1 -3.99 37.06 Favored 'Cis proline' 0 CA--C 1.547 1.169 0 CA-C-N 120.544 1.23 . . . . 0.0 113.36 -9.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -62.26 157.39 19.67 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -169.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -89.2 124.11 65.54 Favored Pre-proline 0 N--CA 1.471 0.606 0 C-N-CA 126.849 2.06 . . . . 0.0 109.968 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.23 81.59 2.42 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 123.465 2.777 . . . . 0.0 110.962 173.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -152.66 149.17 28.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.958 1.303 . . . . 0.0 112.529 -171.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -80.73 54.63 2.17 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.111 -0.993 . . . . 0.0 112.574 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 m -70.89 31.36 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 127.749 2.42 . . . . 0.0 115.305 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 58.68 15.97 4.06 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.017 2.127 . . . . 0.0 114.575 -172.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -149.22 162.38 29.11 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 125.539 1.536 . . . . 0.0 111.634 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.23 159.59 40.37 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.552 2.168 . . . . 0.0 110.668 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -85.54 -54.49 4.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.793 0.837 . . . . 0.0 109.895 171.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.6 t -83.03 137.73 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.598 1.159 . . . . 0.0 109.254 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 78.8 t -130.5 142.6 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-O 121.621 0.724 . . . . 0.0 110.754 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.1 mp -128.66 123.66 59.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 128.147 2.579 . . . . 0.0 109.343 -169.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.9 mt -80.77 159.52 25.15 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 111.452 170.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.11 -24.54 67.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.422 1.089 . . . . 0.0 113.636 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.16 -10.04 59.31 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.856 1.663 . . . . 0.0 113.502 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.04 4.56 59.98 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.603 1.097 . . . . 0.0 114.988 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -72.36 141.56 48.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.637 1.218 . . . . 0.0 109.042 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.6 mm -130.73 153.36 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 124.938 1.295 . . . . 0.0 109.966 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.8 p -49.5 120.48 10.61 Favored Pre-proline 0 N--CA 1.473 0.686 0 C-N-CA 124.767 1.227 . . . . 0.0 111.76 169.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.9 76.67 3.66 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.824 3.016 . . . . 0.0 111.901 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -115.88 -178.53 3.42 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.994 1.718 . . . . 0.0 112.797 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.2 m -138.8 150.85 46.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.141 0.972 . . . . 0.0 112.231 169.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.62 137.92 40.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 127.063 2.145 . . . . 0.0 108.389 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.6 tt -127.88 147.16 50.45 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.18 1.392 . . . . 0.0 110.475 -174.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 65.8 mtt -125.2 130.4 52.05 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 125.047 1.339 . . . . 0.0 109.46 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.08 146.7 50.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.921 1.689 . . . . 0.0 111.426 -176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -46.85 121.55 3.68 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.802 1.241 . . . . 0.0 111.145 171.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.04 -31.37 51.21 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -170.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.07 -21.24 7.84 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.614 0.626 . . . . 0.0 114.183 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.8 m -108.11 -21.71 12.68 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.902 0.881 . . . . 0.0 112.664 -169.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.29 -3.31 78.16 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.663 1.125 . . . . 0.0 114.951 173.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -69.47 122.11 84.51 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 125.599 1.56 . . . . 0.0 111.281 175.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -55.35 141.95 80.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.027 2.484 . . . . 0.0 113.082 170.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.07 -39.05 5.4 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.955 0.902 . . . . 0.0 110.267 169.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.9 tp -149.97 154.69 38.67 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.08 1.352 . . . . 0.0 110.763 -169.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 6.6 m -139.42 145.0 38.35 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.898 1.679 . . . . 0.0 108.339 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.4 mt -123.24 134.79 54.08 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 127.408 2.283 . . . . 0.0 107.632 -175.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 7.7 t -136.02 138.82 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.488 0.715 . . . . 0.0 111.619 -168.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.0 t -114.82 124.98 53.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.221 1.008 . . . . 0.0 111.626 -179.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 74.6 p -74.39 -16.83 60.88 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.171 1.389 . . . . 0.0 114.262 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.78 -1.1 12.13 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 125.504 1.526 . . . . 0.0 113.741 -169.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 7.6 t -154.93 158.77 39.78 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.093 -1.239 . . . . 0.0 113.054 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -59.92 137.21 90.61 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.127 1.771 . . . . 0.0 114.83 -178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -96.59 176.78 9.35 Favored 'Cis proline' 0 CA--C 1.548 1.191 0 CA-C-N 120.04 1.05 . . . . 0.0 111.026 -11.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.56 163.66 20.72 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.127 -0.983 . . . . 0.0 111.069 169.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -117.62 134.21 55.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.626 1.57 . . . . 0.0 111.23 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -89.49 146.08 24.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 111.855 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.9 t -150.36 147.99 28.26 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.151 1.38 . . . . 0.0 111.018 169.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.1 mp -74.76 128.81 36.46 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.557 -0.714 . . . . 0.0 109.116 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 32.02 63.42 0.26 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.281 1.832 . . . . 0.0 115.841 175.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.05 2.29 1.02 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.895 2.478 . . . . 0.0 116.74 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -54.11 -27.15 31.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 116.068 1.877 . . . . 0.0 116.068 -169.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.99 5.49 12.86 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.568 1.547 . . . . 0.0 112.582 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -71.51 -47.72 12.76 Favored Pre-proline 0 N--CA 1.476 0.835 0 CA-C-O 116.568 -1.682 . . . . 0.0 114.761 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 C--O 1.25 1.124 0 C-N-CA 122.546 2.164 . . . . 0.0 113.11 -179.158 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.488 1.461 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.46 -42.89 99.79 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 121.263 -0.898 . . . . 0.0 112.772 176.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.4 p90 -69.39 -23.58 63.74 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.92 160.66 25.24 Favored Glycine 0 CA--C 1.529 0.94 0 CA-C-N 119.226 0.921 . . . . 0.0 113.847 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.2 mtm-85 -131.0 82.69 2.06 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.648 1.979 . . . . 0.0 109.756 -171.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -49.31 -42.93 42.84 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 -170.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.99 -40.64 87.43 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.9 t -66.66 -45.88 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.225 0.61 . . . . 0.0 109.774 173.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.3 -46.55 88.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.545 0.738 . . . . 0.0 112.565 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -58.39 -51.49 69.58 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.615 0.766 . . . . 0.0 112.331 172.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.9 m -57.86 -47.6 82.26 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.362 0.665 . . . . 0.0 111.319 178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -70.5 -29.27 65.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.854 1.261 . . . . 0.0 113.912 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.7 -49.28 71.5 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 120.576 1.535 . . . . 0.0 110.461 171.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -62.48 -40.54 97.01 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.768 1.227 . . . . 0.0 111.936 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -63.23 -47.83 80.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.598 1.159 . . . . 0.0 112.298 172.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 91.2 m -57.7 -40.66 80.03 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.067 0.947 . . . . 0.0 111.204 175.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.36 78.41 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.09 -44.63 96.25 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.566 -0.709 . . . . 0.0 111.665 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -68.28 -39.33 82.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.632 0.773 . . . . 0.0 112.42 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.04 -45.24 91.25 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.69 0.677 . . . . 0.0 111.83 169.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -60.81 -42.99 98.73 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.858 0.754 . . . . 0.0 110.73 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.94 -40.18 94.65 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.957 -1.089 . . . . 0.0 113.538 172.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.96 -31.13 71.86 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.27 1.028 . . . . 0.0 113.092 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.7 tp -73.33 -35.72 66.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.279 1.432 . . . . 0.0 111.427 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -62.11 -45.2 94.54 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.082 -1.011 . . . . 0.0 110.88 169.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 tp -51.9 -46.35 64.55 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.441 1.496 . . . . 0.0 111.075 169.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.82 97.73 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.26 -44.2 99.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.687 0.795 . . . . 0.0 110.598 175.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.56 -49.88 76.07 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.265 0.626 . . . . 0.0 111.562 174.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.0 mmt85 -59.28 -34.81 72.72 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.036 -1.04 . . . . 0.0 112.414 175.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.52 66.96 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.132 0.878 . . . . 0.0 111.765 178.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -25.04 63.11 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.633 -0.667 . . . . 0.0 112.523 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 84.7 mt -81.93 -43.08 18.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.682 1.193 . . . . 0.0 112.381 175.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.5 p -84.24 -17.5 39.58 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -173.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.87 11.68 83.48 Favored Glycine 0 CA--C 1.537 1.454 0 N-CA-C 114.965 0.746 . . . . 0.0 114.965 175.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.89 172.56 6.18 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.185 1.394 . . . . 0.0 110.147 171.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.13 159.64 14.76 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.455 2.103 . . . . 0.0 114.907 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.6 t -130.52 156.49 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 127.249 2.219 . . . . 0.0 107.53 171.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -158.99 169.78 35.3 Favored Glycine 0 N--CA 1.468 0.814 0 CA-C-N 120.323 1.42 . . . . 0.0 116.256 -171.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 49.8 mt -129.43 128.85 66.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 125.178 1.391 . . . . 0.0 108.829 -173.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -107.64 59.95 0.62 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 129.178 2.991 . . . . 0.0 110.635 -168.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -53.84 141.13 28.19 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.3 1.04 . . . . 0.0 112.056 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.5 t -139.42 179.52 6.5 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.067 1.747 . . . . 0.0 111.769 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -66.64 -16.93 64.55 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -169.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 91.0 p -142.81 -5.02 0.92 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.76 -175.36 5.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.065 1.746 . . . . 0.0 110.599 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 45.5 p90 -146.07 164.82 30.92 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.697 1.599 . . . . 0.0 109.851 173.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.6 ttp-105 -148.45 154.97 40.6 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.104 1.762 . . . . 0.0 109.814 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.3 mt -114.82 141.18 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.576 1.151 . . . . 0.0 109.272 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 85.3 mtp -132.6 148.33 52.36 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 -174.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.8 158.28 37.43 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.777 2.431 . . . . 0.0 108.86 -168.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.51 153.09 79.01 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 122.104 1.869 . . . . 0.0 112.034 169.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.3 4.72 0.98 Allowed Glycine 0 CA--C 1.537 1.406 0 N-CA-C 116.772 1.469 . . . . 0.0 116.772 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -137.59 -23.71 1.07 Allowed 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.6 t -158.21 139.09 9.39 Favored Pre-proline 0 N--CA 1.477 0.911 0 CA-C-N 119.44 1.018 . . . . 0.0 112.829 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -88.63 -12.78 3.56 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.299 3.333 . . . . 0.0 112.187 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.7 t -82.96 -22.38 33.77 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.056 1.342 . . . . 0.0 113.479 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -144.78 162.06 37.69 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.349 1.46 . . . . 0.0 111.721 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -52.4 123.34 10.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.472 1.509 . . . . 0.0 112.429 177.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -153.23 160.18 42.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.518 1.527 . . . . 0.0 111.86 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 57.8 m95 -145.28 146.24 31.57 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.693 1.197 . . . . 0.0 113.6 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.1 t -158.01 153.65 22.66 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 128.993 2.917 . . . . 0.0 107.724 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -69.52 134.64 28.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.236 1.958 . . . . 0.0 111.064 173.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.456 ' O ' HD23 ' A' ' 64' ' ' LEU . 2.4 tt -68.68 -26.28 65.22 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 123.328 1.537 . . . . 0.0 109.787 173.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -49.52 -14.31 0.11 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 127.968 2.507 . . . . 0.0 113.746 169.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -53.54 -32.74 51.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.929 1.692 . . . . 0.0 112.753 168.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -135.27 -13.04 2.1 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -176.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -121.58 58.24 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.209 1.403 . . . . 0.0 109.074 169.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.63 -23.43 1.01 Allowed 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 118.544 2.794 . . . . 0.0 118.544 -169.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -121.16 -4.2 9.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -171.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -129.08 -7.0 4.89 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.9 m -75.55 14.37 0.63 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.251 1.02 . . . . 0.0 113.603 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -155.63 -179.2 7.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.42 1.488 . . . . 0.0 110.988 -175.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -51.93 128.02 22.93 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 174.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -168.86 -27.86 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.086 2.154 . . . . 0.0 111.439 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -69.23 -6.25 27.96 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.545 1.938 . . . . 0.0 114.796 -170.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.88 165.44 24.63 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.895 1.678 . . . . 0.0 113.442 -178.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.56 13.22 2.13 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.32 1.448 . . . . 0.0 112.841 171.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -155.09 3.48 0.2 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -168.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -120.19 162.87 18.62 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.292 -1.505 . . . . 0.0 113.482 -169.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 t -135.98 143.3 44.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.043 2.137 . . . . 0.0 108.735 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.9 143.88 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.116 1.366 . . . . 0.0 110.641 -169.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -140.17 134.51 31.3 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.352 1.461 . . . . 0.0 110.601 -178.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mp -113.41 153.03 29.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.235 1.017 . . . . 0.0 113.15 -174.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -145.45 140.34 15.81 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 126.875 2.07 . . . . 0.0 108.745 -172.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -80.1 -5.95 41.37 Favored 'Cis proline' 0 CA--C 1.546 1.077 0 CA-C-N 120.841 1.336 . . . . 0.0 114.015 -3.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -107.35 155.96 19.43 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.84 1.256 . . . . 0.0 113.305 -171.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.82 135.49 95.46 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -169.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -84.16 98.23 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 123.633 2.889 . . . . 0.0 108.797 168.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -148.0 156.38 42.59 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.028 -1.045 . . . . 0.0 112.259 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -76.74 41.75 0.28 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.99 1.716 . . . . 0.0 112.093 172.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 55.5 p -73.2 39.18 0.09 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.622 1.969 . . . . 0.0 115.281 -171.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.6 t30 57.33 19.5 5.1 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 127.022 2.129 . . . . 0.0 115.015 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -158.04 124.33 2.49 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.626 1.17 . . . . 0.0 110.429 -169.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.89 128.94 30.92 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 121.712 1.608 . . . . 0.0 111.212 172.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -78.34 -39.24 40.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.953 0.901 . . . . 0.0 111.311 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -99.98 136.23 32.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.896 1.678 . . . . 0.0 108.174 177.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.5 t -135.54 143.82 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 121.868 0.842 . . . . 0.0 111.108 -172.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.9 mp -125.49 129.56 72.85 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 128.384 2.674 . . . . 0.0 107.968 -171.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.4 mt -94.08 162.62 13.8 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.097 0.951 . . . . 0.0 112.061 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.74 -9.41 6.36 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -175.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -121.12 9.74 10.57 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.746 1.619 . . . . 0.0 113.298 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.74 8.69 59.22 Favored Glycine 0 CA--C 1.535 1.304 0 N-CA-C 115.833 1.093 . . . . 0.0 115.833 173.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -74.93 137.8 41.92 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.9 1.35 . . . . 0.0 108.551 169.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -130.37 146.11 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.909 1.284 . . . . 0.0 109.479 -173.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.2 p -52.24 124.37 30.77 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 124.022 0.929 . . . . 0.0 111.539 170.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.64 112.87 3.59 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.742 2.295 . . . . 0.0 111.096 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.563 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 2.5 p90 -151.45 -179.27 7.24 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.35 1.86 . . . . 0.0 111.661 -176.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -138.19 142.48 40.03 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.622 0.769 . . . . 0.0 112.156 169.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.07 102.77 8.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 129.235 3.014 . . . . 0.0 108.833 -170.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.3 tt -96.62 147.9 23.4 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.544 1.138 . . . . 0.0 110.563 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 53.4 mtt -129.85 135.48 48.44 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.879 1.672 . . . . 0.0 109.271 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -138.66 152.71 48.3 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.158 1.383 . . . . 0.0 111.0 -176.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -61.09 127.28 30.78 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 121.814 -0.554 . . . . 0.0 109.806 175.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.97 -20.34 57.11 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 -175.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.85 -32.65 0.68 Allowed Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.301 0.953 . . . . 0.0 114.582 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 6.9 m -68.38 -27.47 66.26 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.257 1.528 . . . . 0.0 111.255 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 70.55 35.82 68.06 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.806 0.717 . . . . 0.0 113.195 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -133.34 135.61 25.7 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 125.668 1.587 . . . . 0.0 110.439 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.41 152.33 79.0 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 123.012 2.475 . . . . 0.0 113.071 -176.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.34 -55.21 1.76 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.214 1.805 . . . . 0.0 111.565 -173.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -147.98 156.47 42.7 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.57 1.548 . . . . 0.0 108.643 -169.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.6 m -147.46 138.56 23.65 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.059 -1.026 . . . . 0.0 110.243 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -109.61 146.21 35.13 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 126.814 2.046 . . . . 0.0 109.729 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 54.0 t -140.38 137.17 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.098 0.959 . . . . 0.0 112.038 -169.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.563 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 38.4 t -115.27 154.26 29.41 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.906 1.682 . . . . 0.0 111.641 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.4 m -130.35 9.52 5.18 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.944 1.298 . . . . 0.0 113.488 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 120.87 -9.61 10.45 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 114.943 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 85.9 p -156.53 160.07 39.15 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.637 1.219 . . . . 0.0 113.517 -173.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 44.0 t-105 -60.23 138.5 91.65 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.297 1.839 . . . . 0.0 115.501 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -97.9 177.22 7.93 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.128 1.081 . . . . 0.0 110.935 -11.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.26 160.26 32.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.855 169.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -100.81 166.04 11.06 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.065 1.346 . . . . 0.0 109.046 169.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -142.07 153.12 43.94 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 6.2 t -155.86 167.09 31.53 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.233 1.413 . . . . 0.0 112.254 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.89 135.85 48.25 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 109.971 169.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 22.98 70.5 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.724 2.41 . . . . 0.0 116.547 176.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 46.4 ptt85 44.03 31.6 0.54 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 128.798 2.839 . . . . 0.0 118.398 175.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -55.37 -24.04 27.58 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 174.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.6 p -97.43 -0.89 45.43 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 126.822 2.049 . . . . 0.0 113.759 176.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -138.54 62.18 28.17 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 126.33 1.852 . . . . 0.0 110.743 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.268 3.312 . . . . 0.0 113.369 178.968 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.22 165.84 33.59 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.063 1.345 . . . . 0.0 111.525 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -128.44 17.34 6.48 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.065 1.346 . . . . 0.0 113.385 -177.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.33 36.05 0.44 Allowed Glycine 0 CA--C 1.538 1.477 0 C-N-CA 126.575 2.036 . . . . 0.0 115.763 -176.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.7 mtt-85 -61.45 -14.29 27.37 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.365 1.866 . . . . 0.0 114.357 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -51.1 -28.16 10.02 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -175.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.8 -13.51 34.29 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.865 1.266 . . . . 0.0 114.084 172.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -131.71 -44.2 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.681 1.992 . . . . 0.0 111.181 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.56 79.58 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.448 1.499 . . . . 0.0 113.331 -177.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -65.55 -44.79 85.71 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.158 0.89 . . . . 0.0 111.207 178.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.3 m -62.01 -45.82 91.94 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.282 -0.886 . . . . 0.0 111.593 173.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -60.04 -38.55 83.1 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.328 -0.844 . . . . 0.0 112.253 175.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.81 -47.27 87.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.493 1.042 . . . . 0.0 112.032 174.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -63.54 -41.4 98.45 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.217 1.007 . . . . 0.0 111.379 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.98 -53.32 51.97 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 122.694 0.398 . . . . 0.0 111.782 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.0 m -55.76 -37.12 68.1 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.964 1.306 . . . . 0.0 111.425 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.14 -47.74 83.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.38 1.072 . . . . 0.0 113.89 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.81 98.13 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.389 -0.819 . . . . 0.0 112.254 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -65.08 -42.59 93.96 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.485 0.714 . . . . 0.0 110.959 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -60.08 -43.71 95.3 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.199 0.6 . . . . 0.0 112.408 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 34.9 m -59.82 -41.79 92.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 118.597 0.635 . . . . 0.0 111.156 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.39 -40.88 94.02 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.864 -1.148 . . . . 0.0 113.5 172.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.75 -33.51 75.82 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 121.171 -0.956 . . . . 0.0 113.041 175.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.2 tp -69.49 -35.85 75.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.448 1.099 . . . . 0.0 111.742 173.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -63.36 -44.22 95.44 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.91 -1.119 . . . . 0.0 111.773 170.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.57 -45.15 62.99 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.188 1.395 . . . . 0.0 111.471 169.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.54 -43.09 98.11 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.64 -45.79 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 118.898 0.772 . . . . 0.0 110.713 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.87 -23.95 66.62 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -103.03 -24.78 13.61 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.33 74.59 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.983 1.265 . . . . 0.0 113.801 176.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.7 t -69.4 -28.28 66.02 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 121.637 -0.664 . . . . 0.0 112.73 173.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.4 mt -85.2 -28.59 25.34 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.518 1.527 . . . . 0.0 113.219 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -86.44 -15.73 39.34 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -169.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.1 -9.3 33.3 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 124.507 1.051 . . . . 0.0 115.266 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -138.32 150.84 68.03 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 129.447 3.099 . . . . 0.0 105.406 169.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -40.41 154.97 0.05 OUTLIER 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.099 3.199 . . . . 0.0 115.507 169.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.9 t -104.01 161.84 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.871 1.268 . . . . 0.0 108.311 171.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -154.44 176.28 32.3 Favored Glycine 0 CA--C 1.522 0.521 0 CA-C-O 122.299 0.944 . . . . 0.0 114.991 -178.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 63.2 mt -134.95 118.42 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 124.504 1.122 . . . . 0.0 108.002 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -76.8 152.97 35.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.347 1.459 . . . . 0.0 110.687 170.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -143.02 147.85 35.79 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.391 1.477 . . . . 0.0 113.03 -175.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.7 p -136.58 -176.36 4.32 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.569 1.948 . . . . 0.0 111.302 176.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.63 -25.29 62.55 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 178.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 87.6 p -143.2 -2.09 1.02 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -173.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.73 179.87 7.15 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 122.86 1.314 . . . . 0.0 112.988 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.482 ' CZ2' ' HA ' ' A' ' 74' ' ' ASN . 58.6 p-90 -149.15 162.78 39.3 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 127.303 2.241 . . . . 0.0 108.762 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 41.8 mtm-85 -143.96 132.04 21.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.402 1.081 . . . . 0.0 111.208 172.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.3 mm -69.76 130.82 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 171.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.8 mtm -134.11 147.79 50.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 122.077 0.942 . . . . 0.0 111.719 -176.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.7 164.83 33.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.912 1.285 . . . . 0.0 111.786 -169.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.03 -23.41 75.68 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.755 2.97 . . . . 0.0 114.527 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.86 -53.53 1.69 Allowed Glycine 0 CA--C 1.533 1.201 0 C-N-CA 126.929 2.204 . . . . 0.0 116.556 169.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -142.62 -23.05 0.66 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.294 1.437 . . . . 0.0 114.299 -172.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.3 t -133.32 124.12 18.06 Favored Pre-proline 0 N--CA 1.475 0.805 0 CA-C-N 119.021 0.828 . . . . 0.0 113.021 -174.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -86.55 -0.02 8.04 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.82 3.013 . . . . 0.0 111.929 169.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.7 m -111.74 -5.22 14.46 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.662 1.585 . . . . 0.0 114.262 -169.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -141.79 146.04 35.46 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.064 1.346 . . . . 0.0 110.839 172.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.8 t-105 -51.27 -37.26 46.33 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.95 1.7 . . . . 0.0 115.047 -171.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 9.2 tpt85 -27.32 96.97 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 129.007 2.923 . . . . 0.0 115.241 -171.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.22 154.82 34.97 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.305 1.042 . . . . 0.0 112.124 171.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.6 m -143.82 151.0 51.97 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 125.886 1.674 . . . . 0.0 110.164 169.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.14 145.87 80.02 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.183 1.922 . . . . 0.0 110.21 169.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 63.6 tp -57.12 -71.84 0.09 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.337 1.055 . . . . 0.0 113.595 -169.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 43.83 1.79 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 130.612 3.565 . . . . 0.0 120.45 169.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -60.42 -21.76 62.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.499 1.919 . . . . 0.0 115.351 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -150.35 -38.94 0.14 Allowed 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.951 1.701 . . . . 0.0 110.698 170.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.78 44.35 0.08 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.112 2.165 . . . . 0.0 113.12 169.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.31 20.44 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 -169.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -133.36 25.96 4.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.084 1.354 . . . . 0.0 112.033 170.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -120.19 -6.89 9.89 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.848 1.659 . . . . 0.0 111.679 173.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.9 m -71.16 -2.12 14.75 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.804 1.642 . . . . 0.0 113.123 169.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -139.5 168.99 18.58 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.571 1.548 . . . . 0.0 113.253 -175.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.482 ' HA ' ' CZ2' ' A' ' 47' ' ' TRP . 59.0 t30 -51.13 119.55 4.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 117.307 2.336 . . . . 0.0 117.307 -169.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -141.72 10.19 2.01 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.54 2.336 . . . . 0.0 111.459 169.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -79.52 -17.23 54.5 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.03 1.332 . . . . 0.0 113.529 -176.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.11 167.3 28.15 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -144.08 27.71 1.43 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.802 2.041 . . . . 0.0 110.247 169.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -141.45 -5.81 1.06 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.442 1.497 . . . . 0.0 114.636 -169.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 63.2 mt -115.3 163.4 15.74 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.865 1.317 . . . . 0.0 113.614 -170.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 47.2 t -134.38 134.79 42.1 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 128.672 2.789 . . . . 0.0 106.797 169.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.51 144.26 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 124.421 1.088 . . . . 0.0 110.884 -169.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -137.36 157.4 46.67 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.028 1.731 . . . . 0.0 109.585 172.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -153.71 168.56 25.84 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.546 -0.721 . . . . 0.0 112.902 172.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -157.65 155.08 26.43 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.525 1.93 . . . . 0.0 110.269 177.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -77.46 -10.75 31.7 Favored 'Cis proline' 0 CA--C 1.543 0.946 0 CA-C-N 120.898 1.357 . . . . 0.0 114.864 2.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -66.1 -178.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.303 1.441 . . . . 0.0 111.586 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.73 141.11 29.63 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -176.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.39 131.44 24.8 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.825 2.35 . . . . 0.0 110.407 175.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -160.38 -154.52 0.38 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.587 0.755 . . . . 0.0 111.523 -169.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -135.71 26.81 3.36 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.954 2.502 . . . . 0.0 110.148 169.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.2 m -60.37 156.87 14.9 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.124 2.17 . . . . 0.0 115.086 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -71.96 20.05 0.06 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 126.031 1.732 . . . . 0.0 114.84 175.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -150.36 161.29 31.11 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.379 1.872 . . . . 0.0 109.823 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.99 172.07 16.24 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 122.902 2.402 . . . . 0.0 112.964 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -108.64 -10.58 15.19 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.87 1.668 . . . . 0.0 111.958 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.56 139.33 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.238 1.415 . . . . 0.0 108.811 169.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.443 ' H ' HG22 ' A' ' 106' ' ' THR . 58.8 t -134.31 139.3 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 109.577 -175.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.92 119.16 48.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 126.635 1.974 . . . . 0.0 109.5 -169.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -73.64 152.27 40.55 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.373 1.469 . . . . 0.0 111.187 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.01 -28.64 58.15 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.895 1.278 . . . . 0.0 114.127 172.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.94 -11.31 59.59 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.628 1.571 . . . . 0.0 113.58 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 96.25 4.77 59.62 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 124.648 1.118 . . . . 0.0 114.887 -177.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 -72.24 150.99 43.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.491 1.145 . . . . 0.0 108.408 169.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.5 mm -128.82 137.55 56.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 124.774 1.23 . . . . 0.0 108.427 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.443 HG22 ' H ' ' A' ' 98' ' ' VAL . 6.3 t -56.26 133.34 75.61 Favored Pre-proline 0 CA--C 1.544 0.75 0 CA-C-O 118.522 -0.752 . . . . 0.0 111.255 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -59.94 117.53 4.29 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 122.562 2.175 . . . . 0.0 112.82 174.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 5.6 p90 -155.13 175.6 13.63 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.448 1.499 . . . . 0.0 111.356 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 p -142.14 153.2 43.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.499 1.12 . . . . 0.0 110.508 169.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.12 134.67 33.18 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.884 2.073 . . . . 0.0 109.142 -169.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -125.71 143.17 51.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.461 1.504 . . . . 0.0 110.383 -175.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.4 mtt -122.07 128.98 51.98 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.556 1.542 . . . . 0.0 109.667 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.11 146.16 50.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.64 1.576 . . . . 0.0 111.573 -175.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -54.18 124.98 17.36 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.48 1.112 . . . . 0.0 109.927 171.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.55 -14.07 17.76 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 -174.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -103.9 -50.05 1.04 Allowed Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.917 1.246 . . . . 0.0 113.417 179.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.4 p -79.45 -27.77 41.62 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.442 1.121 . . . . 0.0 113.558 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.97 8.27 73.05 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.987 0.803 . . . . 0.0 113.01 -169.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.38 134.66 58.22 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 124.901 1.28 . . . . 0.0 110.836 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.57 144.13 65.38 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.787 2.325 . . . . 0.0 112.663 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.24 -40.38 4.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.922 0.889 . . . . 0.0 110.125 169.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.45 154.81 38.36 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.327 1.051 . . . . 0.0 111.383 -169.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 22.9 m -145.75 145.78 30.97 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.966 1.307 . . . . 0.0 109.986 177.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.5 mp -120.17 144.55 47.63 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.122 2.569 . . . . 0.0 109.365 -179.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 15.9 t -142.23 138.07 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.253 1.021 . . . . 0.0 111.581 -170.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 10.6 t -116.7 152.89 33.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.432 1.093 . . . . 0.0 112.234 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 39.6 m -130.5 5.86 4.77 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.312 1.445 . . . . 0.0 113.19 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 130.85 -15.25 5.43 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 115.915 1.126 . . . . 0.0 115.915 172.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.2 t -151.64 159.04 44.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.76 1.78 . . . . 0.0 113.798 -172.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 -57.5 135.28 82.02 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 126.465 1.906 . . . . 0.0 115.524 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -96.28 175.98 10.34 Favored 'Cis proline' 0 CA--C 1.547 1.146 0 CA-C-N 120.139 1.086 . . . . 0.0 110.603 -11.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.43 161.75 22.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.245 1.022 . . . . 0.0 112.085 169.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -90.12 154.79 19.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.208 1.403 . . . . 0.0 107.788 169.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -139.44 152.54 47.12 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.3 t -155.18 151.35 28.09 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.692 1.197 . . . . 0.0 112.031 -169.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.98 131.92 45.85 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 169.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 29.57 66.08 0.12 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.628 1.971 . . . . 0.0 115.267 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 52.05 13.77 0.29 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 118.58 2.808 . . . . 0.0 118.58 178.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -57.51 -32.17 66.76 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.369 1.988 . . . . 0.0 116.369 -169.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 68.3 p -79.77 -18.21 51.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 68.4 ttt-85 -66.73 -47.03 56.54 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-O 116.54 -1.695 . . . . 0.0 115.263 -171.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo . . . . . 0 C--O 1.249 1.071 0 C-N-CA 122.729 2.286 . . . . 0.0 113.223 -178.428 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.569 -0.16 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.56 167.85 24.31 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.131 1.372 . . . . 0.0 111.75 177.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -67.98 -14.51 63.02 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -167.03 -174.7 36.47 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 125.534 1.54 . . . . 0.0 112.824 -178.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -78.28 57.85 1.97 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.744 1.618 . . . . 0.0 113.969 -170.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -46.54 -42.48 15.85 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.796 2.038 . . . . 0.0 114.385 -178.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -66.57 -42.07 87.62 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.24 -40.05 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.716 -0.659 . . . . 0.0 109.987 175.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.3 95.95 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 119.311 0.959 . . . . 0.0 112.659 173.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.19 -42.43 96.65 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.049 -1.032 . . . . 0.0 111.575 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.0 m -61.16 -50.37 73.42 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.745 0.818 . . . . 0.0 111.711 173.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -57.46 -40.4 78.44 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.914 1.686 . . . . 0.0 112.408 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.98 72.01 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.989 0.813 . . . . 0.0 111.376 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -61.73 -41.69 97.99 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.129 0.972 . . . . 0.0 111.876 177.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.47 -50.01 71.38 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.767 1.227 . . . . 0.0 112.538 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 61.8 m -65.28 -30.26 71.11 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.237 -0.915 . . . . 0.0 112.113 174.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.9 87.31 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.679 1.127 . . . . 0.0 113.496 172.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.85 -43.76 98.2 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.35 -0.844 . . . . 0.0 111.372 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -64.76 -39.2 93.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.525 0.73 . . . . 0.0 112.664 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -61.31 -42.5 98.77 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 111.774 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.8 m -59.32 -43.86 92.64 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.424 0.556 . . . . 0.0 110.727 175.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.36 -41.87 96.5 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.981 -1.075 . . . . 0.0 113.474 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.86 -32.71 74.32 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.997 0.919 . . . . 0.0 113.128 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.9 tp -73.04 -33.87 65.96 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.06 1.344 . . . . 0.0 111.683 173.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.41 -44.23 95.26 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.948 -1.095 . . . . 0.0 110.877 169.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.7 -45.33 66.82 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.34 1.456 . . . . 0.0 111.288 169.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.61 98.03 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.92 -47.29 93.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.088 0.858 . . . . 0.0 110.684 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -60.34 -35.44 75.65 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.708 0.803 . . . . 0.0 112.796 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -76.29 -36.63 58.26 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.389 0.676 . . . . 0.0 112.626 174.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.92 -36.06 82.72 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.833 1.197 . . . . 0.0 112.96 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.1 t -73.32 -27.32 61.46 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.9 -25.34 23.3 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.9 m -89.28 -22.07 22.88 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -169.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.75 5.85 89.27 Favored Glycine 0 CA--C 1.542 1.734 0 N-CA-C 115.043 0.777 . . . . 0.0 115.043 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -143.44 150.81 52.67 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 127.653 2.381 . . . . 0.0 107.302 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -46.24 163.25 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.761 2.974 . . . . 0.0 114.593 169.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -123.37 160.72 26.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.616 1.566 . . . . 0.0 108.459 176.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.63 173.75 34.37 Favored Glycine 0 CA--C 1.521 0.458 0 N-CA-C 116.111 1.204 . . . . 0.0 116.111 -177.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.2 mt -132.63 123.66 49.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.832 1.253 . . . . 0.0 108.998 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -83.48 145.76 28.76 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.597 1.959 . . . . 0.0 110.758 170.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -141.55 145.2 34.82 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.311 1.445 . . . . 0.0 111.801 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.2 p -146.83 176.12 10.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.996 1.318 . . . . 0.0 112.056 172.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -61.09 -10.11 5.66 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.445 1.098 . . . . 0.0 113.86 170.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.9 m -130.7 -15.8 3.44 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.92 168.73 24.82 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 123.178 1.466 . . . . 0.0 114.079 -178.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -135.74 144.33 45.8 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 128.904 2.882 . . . . 0.0 105.478 169.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -160.01 129.62 5.26 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.674 0.79 . . . . 0.0 111.508 -172.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mt -92.57 139.36 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.2 mtp -136.66 145.27 44.59 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.038 0.935 . . . . 0.0 112.189 -169.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 m -138.46 160.79 62.22 Favored Pre-proline 0 N--CA 1.473 0.701 0 C-N-CA 126.574 1.95 . . . . 0.0 112.137 -169.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -81.17 12.04 2.82 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.048 3.165 . . . . 0.0 115.406 -171.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -39.66 -40.17 1.44 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 127.005 2.24 . . . . 0.0 118.687 -169.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -69.1 -44.5 72.35 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.219 1.51 . . . . 0.0 112.895 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.2 t -167.92 129.87 1.24 Allowed Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 123.935 0.894 . . . . 0.0 112.83 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.2 -24.6 6.55 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.029 2.486 . . . . 0.0 111.725 169.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.4 m -75.18 -24.86 57.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.542 1.537 . . . . 0.0 113.517 -175.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.48 21.06 4.73 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.339 1.455 . . . . 0.0 112.674 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . 0.27 0.0 OUTLIER 54.08 -13.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 131.567 3.947 . . . . 0.0 120.288 173.475 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -38.74 110.01 0.12 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 128.062 2.545 . . . . 0.0 114.198 -170.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.87 153.92 40.64 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 125.172 1.389 . . . . 0.0 113.92 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 t -136.49 140.59 32.84 Favored Pre-proline 0 N--CA 1.469 0.495 0 C-N-CA 126.891 2.076 . . . . 0.0 108.194 -179.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -63.53 151.71 83.69 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 CA-C-N 121.156 1.449 . . . . 0.0 109.716 169.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 15.8 tp -65.65 12.7 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 114.787 1.402 . . . . 0.0 114.787 -176.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -61.38 -13.53 20.64 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.022 -1.674 . . . . 0.0 114.077 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.58 -15.09 24.3 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.358 1.063 . . . . 0.0 113.424 169.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -141.58 -44.59 0.36 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.091 1.356 . . . . 0.0 112.389 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.56 47.69 1.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.212 1.805 . . . . 0.0 111.697 173.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.7 -35.15 1.71 Allowed 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 -169.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -129.08 15.25 6.26 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.212 1.405 . . . . 0.0 112.578 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -143.46 6.05 1.45 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -174.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 82.6 p -58.18 -20.13 38.69 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -157.95 168.89 25.87 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.49 1.516 . . . . 0.0 113.48 -169.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 45.0 t30 58.81 -41.1 0.07 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.84 3.256 . . . . 0.0 118.008 173.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -73.19 70.42 1.12 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.309 1.844 . . . . 0.0 111.331 176.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -129.15 -28.71 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -168.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.58 176.65 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.413 1.006 . . . . 0.0 113.642 -176.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -125.93 -25.04 3.67 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.579 1.952 . . . . 0.0 113.477 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -139.17 14.53 2.62 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.383 1.073 . . . . 0.0 113.599 -169.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -124.16 156.19 37.14 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -168.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.3 m -133.01 134.3 44.25 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.565 2.746 . . . . 0.0 107.806 169.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -113.37 141.51 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.366 1.066 . . . . 0.0 110.55 -169.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -140.1 85.56 2.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.554 1.542 . . . . 0.0 110.426 -170.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.3 157.22 37.43 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.928 -1.107 . . . . 0.0 112.486 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.82 145.34 27.45 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.852 1.661 . . . . 0.0 109.365 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.56 -14.29 24.46 Favored 'Cis proline' 0 CA--C 1.543 0.975 0 CA-C-N 120.076 1.063 . . . . 0.0 113.825 -4.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -60.62 119.95 9.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.142 1.377 . . . . 0.0 112.328 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.43 145.83 85.89 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.262 1.025 . . . . 0.0 113.505 -177.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.92 63.96 8.73 Favored 'Trans proline' 0 CA--C 1.548 1.207 0 C-N-CA 124.311 3.341 . . . . 0.0 112.386 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -147.67 159.13 44.12 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.158 1.383 . . . . 0.0 111.735 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -74.34 89.63 2.1 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.655 1.217 . . . . 0.0 113.594 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 p -61.02 -3.41 0.79 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 128.043 2.537 . . . . 0.0 116.224 171.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 2.6 p30 54.31 6.9 0.12 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 127.476 2.31 . . . . 0.0 115.82 -169.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -140.84 165.37 30.04 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 128.66 2.784 . . . . 0.0 108.23 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.2 155.09 65.26 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-N 120.094 1.069 . . . . 0.0 112.155 169.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -102.37 -44.55 5.36 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.595 1.158 . . . . 0.0 110.72 177.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 39.3 t -76.79 135.72 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 169.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.47 ' H ' HG22 ' A' ' 106' ' ' THR . 89.7 t -136.04 139.12 46.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.684 1.194 . . . . 0.0 109.745 -177.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.5 119.43 50.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 127.578 2.351 . . . . 0.0 108.206 -170.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -83.23 159.55 21.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.768 0.794 . . . . 0.0 111.355 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.25 -26.12 50.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.074 1.349 . . . . 0.0 114.449 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -76.01 -16.67 59.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.805 1.642 . . . . 0.0 113.595 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 92.05 7.14 64.41 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.331 0.967 . . . . 0.0 114.498 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -84.66 143.23 29.35 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 169.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.4 mm -125.75 149.77 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 125.14 1.376 . . . . 0.0 109.966 -168.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.47 HG22 ' H ' ' A' ' 98' ' ' VAL . 11.8 t -56.34 134.07 76.08 Favored Pre-proline 0 CA--C 1.545 0.772 0 O-C-N 121.655 -0.653 . . . . 0.0 110.925 169.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -75.65 117.35 4.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.51 2.14 . . . . 0.0 111.216 173.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.518 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 10.1 p90 -149.05 179.09 8.14 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 127.055 2.142 . . . . 0.0 111.021 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -138.59 155.54 48.25 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 111.246 169.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.4 tp -136.97 103.72 5.24 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.875 2.07 . . . . 0.0 108.985 -169.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.9 tt -95.19 147.09 23.83 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.364 0.665 . . . . 0.0 110.446 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 59.0 mtt -126.7 125.66 42.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.741 1.616 . . . . 0.0 110.392 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -127.79 140.1 52.25 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.205 1.402 . . . . 0.0 111.55 -176.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -64.52 119.38 10.34 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.142 0.977 . . . . 0.0 110.565 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.43 -22.03 52.93 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 178.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -84.38 -19.57 60.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.724 1.154 . . . . 0.0 115.269 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.2 p -135.18 -24.56 1.42 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.276 1.538 . . . . 0.0 114.445 -170.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 84.6 -1.78 88.56 Favored Glycine 0 CA--C 1.538 1.49 0 C-N-CA 124.975 1.274 . . . . 0.0 114.105 -172.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -79.45 138.97 55.18 Favored Pre-proline 0 CA--C 1.545 0.773 0 CA-C-N 118.682 1.241 . . . . 0.0 112.22 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.14 146.42 57.81 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 122.779 2.319 . . . . 0.0 111.642 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.94 -42.06 2.85 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.976 0.91 . . . . 0.0 111.265 174.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 11.1 tp -148.86 159.73 43.9 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.589 1.156 . . . . 0.0 111.245 -168.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.8 m -148.2 139.99 23.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.728 1.211 . . . . 0.0 109.521 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.9 mp -109.55 144.82 37.32 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.524 1.93 . . . . 0.0 109.374 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 35.1 t -138.48 136.14 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.654 1.182 . . . . 0.0 111.366 -169.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.518 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 20.1 t -115.98 154.87 29.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.108 1.363 . . . . 0.0 111.843 178.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.5 m -131.98 9.95 4.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.187 1.395 . . . . 0.0 113.267 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 115.89 -6.75 19.81 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.85 1.214 . . . . 0.0 115.217 176.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 73.4 m -149.05 150.66 33.15 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.649 1.224 . . . . 0.0 113.33 -169.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 39.2 t-105 -58.45 137.0 85.66 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 124.909 1.284 . . . . 0.0 114.41 173.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -96.17 174.66 11.54 Favored 'Cis proline' 0 CA--C 1.548 1.198 0 CA-C-N 120.147 1.088 . . . . 0.0 111.032 -11.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.28 166.01 15.13 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 122.076 0.941 . . . . 0.0 110.937 169.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -110.54 165.05 12.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.999 1.32 . . . . 0.0 109.132 171.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -141.98 155.66 45.45 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.4 t -151.87 151.08 30.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.678 1.591 . . . . 0.0 111.005 -173.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.73 133.04 47.82 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 27.77 67.91 0.07 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.871 2.068 . . . . 0.0 115.431 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.262 0.0 OUTLIER 50.05 16.47 0.24 Allowed 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.28 -34.32 70.39 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.702 1.741 . . . . 0.0 115.702 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.5 p -88.26 -12.31 44.02 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 174.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -61.8 134.91 94.2 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.011 0.925 . . . . 0.0 112.523 -169.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo . . . . . 0 C--O 1.25 1.088 0 C-N-CA 123.691 2.927 . . . . 0.0 113.264 168.878 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 110.542 -0.17 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.28 167.26 4.24 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.323 1.049 . . . . 0.0 113.612 175.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 p90 -58.7 -27.55 64.95 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.756 1.222 . . . . 0.0 114.136 176.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -178.83 159.79 25.06 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.756 1.17 . . . . 0.0 112.643 176.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 54.0 mmm-85 -84.29 63.54 7.81 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.901 1.281 . . . . 0.0 112.389 -175.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -48.46 -41.23 28.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.175 0.99 . . . . 0.0 112.045 173.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -62.46 -11.59 16.94 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.801 2.04 . . . . 0.0 115.156 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.07 -44.44 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 125.652 1.581 . . . . 0.0 110.088 173.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.23 -38.42 86.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -56.23 -50.02 72.48 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.275 0.943 . . . . 0.0 112.65 172.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.6 m -64.77 -49.59 70.16 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.564 0.746 . . . . 0.0 111.131 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -72.16 -26.82 62.24 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -172.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.06 -53.32 58.62 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.44 1.018 . . . . 0.0 110.767 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -66.47 -36.56 83.07 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.286 0.634 . . . . 0.0 112.502 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -59.69 -48.6 81.02 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.836 0.854 . . . . 0.0 112.17 169.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.3 m -58.93 -41.51 87.52 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.538 0.735 . . . . 0.0 111.179 176.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.62 -40.4 88.76 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 175.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.7 96.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.339 -0.851 . . . . 0.0 111.533 174.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.34 -44.56 96.2 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.829 0.852 . . . . 0.0 111.704 174.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -59.81 -44.34 94.06 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 172.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 48.3 m -61.16 -44.04 97.94 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.819 0.736 . . . . 0.0 110.8 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.76 95.36 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.053 -1.029 . . . . 0.0 113.165 172.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.18 -33.94 77.2 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.016 0.926 . . . . 0.0 113.143 175.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.1 tp -71.7 -33.16 68.55 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.654 1.182 . . . . 0.0 112.143 171.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -63.93 -43.74 94.96 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.888 -1.132 . . . . 0.0 111.14 169.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.33 -45.54 69.11 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.77 1.628 . . . . 0.0 111.255 169.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.32 -47.04 86.01 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.478 0.711 . . . . 0.0 112.394 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -59.11 -41.23 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.787 -1.196 . . . . 0.0 111.401 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.04 -42.32 97.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.439 0.696 . . . . 0.0 112.768 172.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -63.44 -35.08 79.24 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.603 1.161 . . . . 0.0 112.943 176.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.0 95.07 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -174.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.3 t -76.85 -23.08 52.71 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 98.6 mt -89.61 -36.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.64 1.176 . . . . 0.0 113.172 -176.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.0 p -84.34 -16.58 42.41 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.47 -0.01 76.95 Favored Glycine 0 CA--C 1.538 1.511 0 N-CA-C 115.82 1.088 . . . . 0.0 115.82 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -142.59 149.25 49.92 Favored Pre-proline 0 N--CA 1.471 0.582 0 C-N-CA 126.438 1.895 . . . . 0.0 108.576 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -47.66 144.81 10.25 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.214 1.942 . . . . 0.0 111.077 168.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.5 m -109.39 175.12 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.773 0.829 . . . . 0.0 111.15 -178.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.38 165.69 30.95 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 115.408 0.923 . . . . 0.0 115.408 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.47 116.07 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 124.915 1.286 . . . . 0.0 107.955 177.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 34.5 t-80 -80.52 147.14 30.98 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 126.775 2.03 . . . . 0.0 111.243 173.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -143.9 142.18 30.65 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.706 1.602 . . . . 0.0 111.622 -179.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 24.1 p -132.94 177.0 7.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.782 1.633 . . . . 0.0 111.553 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -57.99 -14.72 7.0 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 170.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.9 m -137.06 -10.72 1.74 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -169.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -157.34 174.4 15.49 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.932 1.242 . . . . 0.0 112.602 179.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 12.4 p90 -142.07 156.06 45.39 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.409 1.484 . . . . 0.0 110.018 169.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -150.91 151.93 32.89 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.167 1.387 . . . . 0.0 110.64 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 6.0 mt -109.15 141.84 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.977 0.808 . . . . 0.0 109.606 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 89.1 mtp -134.74 149.98 50.51 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.421 1.088 . . . . 0.0 111.407 -175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.4 m -142.48 169.19 11.38 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 127.073 2.149 . . . . 0.0 111.372 -169.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -55.94 -36.37 95.65 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.476 2.784 . . . . 0.0 114.862 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 66.14 -42.38 0.16 Allowed Glycine 0 CA--C 1.541 1.659 0 C-N-CA 127.147 2.308 . . . . 0.0 117.037 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -143.84 -31.25 0.47 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -172.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.4 p -134.0 57.06 22.06 Favored Pre-proline 0 N--CA 1.485 1.289 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -169.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -62.24 -20.51 70.29 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 122.871 2.381 . . . . 0.0 114.547 -177.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -64.11 -8.94 13.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.322 1.449 . . . . 0.0 114.453 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -135.98 -128.53 0.15 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.262 1.825 . . . . 0.0 110.595 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -139.53 118.42 12.48 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.685 1.594 . . . . 0.0 109.894 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -152.53 159.5 43.29 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.36 1.464 . . . . 0.0 110.654 176.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 40.8 m95 -136.4 130.32 32.55 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.695 1.198 . . . . 0.0 112.239 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.2 t -142.38 138.0 16.08 Favored Pre-proline 0 N--CA 1.471 0.592 0 C-N-CA 126.748 2.019 . . . . 0.0 108.051 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -50.77 131.6 34.3 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.223 2.615 . . . . 0.0 112.81 170.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 29.4 tp -68.28 108.14 3.08 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.033 0.933 . . . . 0.0 111.02 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -138.61 -13.15 1.3 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -54.48 -29.04 48.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.604 1.562 . . . . 0.0 114.382 -172.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -142.28 27.06 1.77 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.178 1.791 . . . . 0.0 111.769 169.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -143.42 39.04 1.4 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.692 2.397 . . . . 0.0 109.541 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.13 -24.03 2.51 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 117.033 2.235 . . . . 0.0 117.033 -168.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -132.34 20.51 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.635 1.574 . . . . 0.0 112.031 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -132.39 4.3 3.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.384 1.474 . . . . 0.0 113.29 -170.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -34.86 41.15 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.157 1.783 . . . . 0.0 114.705 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -130.86 151.08 51.68 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.533 1.933 . . . . 0.0 111.277 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -146.09 158.64 43.88 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.078 1.351 . . . . 0.0 112.493 -169.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -158.18 58.68 0.46 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.89 2.076 . . . . 0.0 109.006 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 9.7 m0 -59.91 -24.34 64.23 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 117.02 2.23 . . . . 0.0 117.02 -169.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 166.06 20.16 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.731 1.15 . . . . 0.0 113.791 -177.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -137.4 15.14 2.98 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.45 1.1 . . . . 0.0 112.638 169.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.51 7.6 0.25 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.879 1.271 . . . . 0.0 113.817 -171.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -127.76 169.44 13.85 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.479 1.511 . . . . 0.0 112.03 -172.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -138.61 140.92 39.12 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 126.565 1.946 . . . . 0.0 109.024 169.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -105.8 143.97 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 125.339 1.456 . . . . 0.0 110.258 -173.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -137.52 152.82 49.89 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.614 1.966 . . . . 0.0 109.728 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 85' ' ' GLN . 1.5 tt -151.16 146.23 25.97 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.868 0.867 . . . . 0.0 111.98 -170.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.3 pp0? -149.14 156.71 40.18 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 125.408 1.483 . . . . 0.0 110.517 169.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -77.2 -16.13 25.61 Favored 'Cis proline' 0 CA--C 1.541 0.843 0 CA-C-N 120.355 1.163 . . . . 0.0 114.128 -0.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -70.08 151.57 45.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.57 1.148 . . . . 0.0 113.418 -175.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -63.45 119.3 52.26 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 125.896 1.678 . . . . 0.0 112.582 178.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -80.29 64.85 8.92 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.137 3.225 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -145.92 157.3 43.9 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.262 1.425 . . . . 0.0 111.587 -174.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -66.7 75.46 0.11 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.826 1.65 . . . . 0.0 113.872 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.9 t -75.85 159.15 31.28 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.653 1.981 . . . . 0.0 113.146 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -72.16 -8.59 55.55 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.317 1.447 . . . . 0.0 113.085 169.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -134.41 163.97 47.33 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 125.825 1.65 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.34 145.16 37.97 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 121.549 1.5 . . . . 0.0 110.466 168.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -73.91 -53.24 10.57 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.227 1.011 . . . . 0.0 111.017 173.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.0 t -81.92 140.31 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.667 1.187 . . . . 0.0 109.496 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 53.7 t -130.91 142.9 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.959 0.903 . . . . 0.0 111.07 174.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.99 127.42 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 127.784 2.433 . . . . 0.0 108.736 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.3 mt -89.12 156.9 18.52 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.394 0.616 . . . . 0.0 111.307 170.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.2 -21.77 60.0 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -71.16 -20.27 62.32 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.976 1.71 . . . . 0.0 113.575 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.62 3.3 62.75 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.897 1.237 . . . . 0.0 114.775 -177.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -83.02 147.09 28.37 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 118.455 1.127 . . . . 0.0 108.663 169.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.1 mm -131.42 155.89 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 124.935 1.294 . . . . 0.0 110.241 -168.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.7 p -55.67 129.6 70.74 Favored Pre-proline 0 N--CA 1.471 0.587 0 O-C-N 121.273 -0.892 . . . . 0.0 110.224 169.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -71.89 119.88 6.49 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.186 1.924 . . . . 0.0 111.456 175.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.479 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 13.1 p90 -149.84 174.74 12.32 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 126.229 1.811 . . . . 0.0 111.337 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 94.7 p -137.53 151.62 48.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.683 0.754 . . . . 0.0 111.118 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -139.76 128.32 22.99 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.281 1.832 . . . . 0.0 108.48 -169.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -123.24 150.96 42.78 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.611 1.565 . . . . 0.0 110.275 -173.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.5 mtt -129.67 142.13 50.78 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 124.873 1.269 . . . . 0.0 109.614 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -137.5 143.65 41.8 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.02 1.328 . . . . 0.0 111.046 -177.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -63.19 122.09 15.28 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.683 0.674 . . . . 0.0 110.133 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.07 -23.32 65.38 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -176.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -97.5 -48.67 1.95 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.766 1.174 . . . . 0.0 113.037 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.3 m -66.87 -31.28 71.78 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 117.951 0.875 . . . . 0.0 112.046 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.68 30.63 61.59 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 123.998 0.809 . . . . 0.0 113.665 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -133.36 149.35 72.17 Favored Pre-proline 0 N--CA 1.474 0.729 0 C-N-CA 125.873 1.669 . . . . 0.0 111.218 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.17 152.03 83.57 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.173 2.582 . . . . 0.0 112.2 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.76 -45.87 1.17 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 126.082 1.753 . . . . 0.0 112.36 -169.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.4 tp -151.66 154.74 36.97 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.33 1.452 . . . . 0.0 109.275 -173.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -146.38 144.79 29.98 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 123.856 0.862 . . . . 0.0 109.628 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.5 mt -126.0 136.38 52.92 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.561 2.345 . . . . 0.0 108.168 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.99 126.93 43.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.399 1.08 . . . . 0.0 110.708 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.479 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 43.4 t -93.82 -44.31 8.18 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -172.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 20.4 m 54.18 -5.54 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 -173.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 134.65 -1.5 3.97 Favored Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.342 1.448 . . . . 0.0 116.001 171.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 6.2 t -156.67 156.18 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.858 1.829 . . . . 0.0 114.88 -172.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.5 t-105 -61.18 137.53 94.27 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 125.812 1.645 . . . . 0.0 114.937 175.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -94.69 174.58 13.72 Favored 'Cis proline' 0 CA--C 1.546 1.09 0 CA-C-N 120.048 1.053 . . . . 0.0 110.487 -11.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.29 145.72 55.42 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.625 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -96.9 127.56 42.99 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.092 1.757 . . . . 0.0 110.555 -178.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -96.17 143.66 27.08 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.526 1.53 . . . . 0.0 112.252 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 15.1 t -147.35 151.96 37.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.582 1.553 . . . . 0.0 111.334 170.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 95.3 mt -71.57 132.62 44.92 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 28.48 64.34 0.11 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.939 2.096 . . . . 0.0 115.732 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 0.0 OUTLIER 48.58 15.44 0.09 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 128.655 2.782 . . . . 0.0 117.891 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -58.25 -39.49 79.29 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -172.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.4 m -86.53 -15.05 41.21 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.51 1.124 . . . . 0.0 112.836 178.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 48.9 ttt-85 -66.98 138.02 94.91 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 120.991 -1.068 . . . . 0.0 112.237 -171.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 123.629 2.886 . . . . 0.0 113.137 168.648 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.4 mtm . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.309 0.1 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.22 -21.28 66.3 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 178.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 53.5 p90 -149.68 169.23 21.49 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.016 1.726 . . . . 0.0 111.412 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.14 -31.25 0.21 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 123.766 0.698 . . . . 0.0 114.712 177.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.1 mtp85 -73.83 6.34 3.35 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -53.72 -33.84 56.88 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -174.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.65 -36.15 78.21 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.311 -0.868 . . . . 0.0 112.6 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.3 t -73.55 -36.14 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.543 1.137 . . . . 0.0 110.584 173.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.86 70.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.605 1.162 . . . . 0.0 112.701 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.412 ' HA ' HD12 ' A' ' 121' ' ' LEU . 24.7 t-20 -57.83 -56.53 20.73 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.418 1.008 . . . . 0.0 112.418 169.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.4 m -58.9 -46.24 88.36 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.604 0.761 . . . . 0.0 111.297 178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -65.96 -36.11 82.44 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 117.516 -1.231 . . . . 0.0 113.249 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.28 70.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.889 1.677 . . . . 0.0 110.978 171.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -61.89 -40.8 96.68 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.734 1.214 . . . . 0.0 111.973 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.7 tp10 -64.37 -50.19 68.65 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.265 1.426 . . . . 0.0 112.465 173.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 92.2 m -58.5 -37.17 75.02 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.173 1.389 . . . . 0.0 111.032 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.41 -44.93 70.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.666 1.187 . . . . 0.0 114.142 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.367 -0.833 . . . . 0.0 111.571 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -67.39 -39.42 85.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.736 0.815 . . . . 0.0 112.315 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.33 -39.85 92.06 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.094 0.861 . . . . 0.0 112.068 171.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.6 m -58.83 -42.09 88.44 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.57 -0.707 . . . . 0.0 110.827 174.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.21 -36.92 85.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.793 -1.192 . . . . 0.0 113.973 171.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.71 -32.91 73.88 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 120.774 -1.204 . . . . 0.0 113.321 174.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.9 tp -70.07 -34.73 73.56 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.192 -0.942 . . . . 0.0 111.637 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -62.6 -45.22 93.87 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 121.162 -0.961 . . . . 0.0 111.579 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.1 tp -53.98 -48.22 70.58 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.522 1.129 . . . . 0.0 111.542 170.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.14 -42.17 80.48 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 176.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.11 -45.19 97.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.195 -0.941 . . . . 0.0 111.123 172.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.42 -6.83 7.98 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.578 1.551 . . . . 0.0 113.884 174.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 57.4 mmt-85 -109.54 -31.36 7.53 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.932 1.293 . . . . 0.0 112.139 172.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.33 -33.49 74.79 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.037 1.289 . . . . 0.0 113.055 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 t -69.5 -15.34 63.23 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 173.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 67.7 mt -112.71 -30.9 6.92 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.554 1.542 . . . . 0.0 114.15 -173.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.6 m -77.59 -21.36 52.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -169.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.3 -5.19 60.53 Favored Glycine 0 CA--C 1.543 1.787 0 N-CA-C 115.284 0.874 . . . . 0.0 115.284 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -136.48 150.32 70.13 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 128.428 2.691 . . . . 0.0 106.566 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -45.9 151.49 1.38 Allowed 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.819 2.346 . . . . 0.0 112.815 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.4 t -113.49 160.25 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.224 1.41 . . . . 0.0 108.788 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -149.21 172.67 29.25 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 115.39 0.916 . . . . 0.0 115.39 -176.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 53.2 mt -134.77 113.99 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 C-N-CA 124.902 1.281 . . . . 0.0 109.132 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -75.18 149.03 39.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.91 1.284 . . . . 0.0 110.008 169.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -136.8 139.35 41.71 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.326 1.45 . . . . 0.0 112.638 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.1 p -115.62 -175.49 2.73 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.248 1.819 . . . . 0.0 109.819 169.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -65.86 -10.37 37.52 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 173.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 94.5 p -146.15 -11.63 0.49 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 -172.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -142.45 169.9 16.71 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.208 1.367 . . . . 0.0 112.47 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 35.6 p-90 -123.25 161.76 23.95 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.82 1.648 . . . . 0.0 110.323 171.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -146.71 121.7 10.04 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.176 1.39 . . . . 0.0 110.586 174.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.2 mm -80.94 138.39 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 95.0 mtp -137.69 144.36 41.75 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.153 0.981 . . . . 0.0 111.388 -171.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.7 m -140.61 166.31 23.95 Favored Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 127.478 2.311 . . . . 0.0 111.176 -169.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -61.62 167.61 9.69 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.0 2.467 . . . . 0.0 114.162 173.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.86 164.69 31.86 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.434 1.969 . . . . 0.0 110.256 169.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 85.1 tttt 59.38 -52.5 0.06 Allowed 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 127.909 2.484 . . . . 0.0 115.469 -169.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 t -152.88 142.48 14.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 125.817 1.647 . . . . 0.0 112.208 -172.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -80.17 -16.65 10.92 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.435 2.757 . . . . 0.0 112.532 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 m -82.14 -5.89 58.78 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -169.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -146.95 150.33 34.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.891 1.276 . . . . 0.0 111.664 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -55.35 115.59 2.36 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.774 1.63 . . . . 0.0 112.088 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.3 tpt85 -153.29 154.47 34.67 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.519 1.528 . . . . 0.0 110.1 176.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -137.94 148.62 45.44 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.952 0.901 . . . . 0.0 112.823 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.4 t -150.79 144.44 17.26 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 129.633 3.173 . . . . 0.0 106.791 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -62.92 154.43 66.76 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 CA-C-N 121.795 1.677 . . . . 0.0 111.307 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.6 21.8 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -61.33 -10.22 6.73 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.02 -2.3 . . . . 0.0 114.023 177.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -65.92 -20.72 66.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.327 1.051 . . . . 0.0 113.061 169.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.87 -12.48 0.56 Allowed 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -177.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -127.28 55.8 1.57 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.731 2.412 . . . . 0.0 108.091 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -39.88 -38.72 0.72 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 117.327 2.343 . . . . 0.0 117.327 -169.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -130.76 18.6 5.14 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.547 1.539 . . . . 0.0 112.033 178.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -136.85 1.51 2.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.786 1.635 . . . . 0.0 113.024 -170.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.1 p -60.85 -16.28 39.62 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.758 1.623 . . . . 0.0 115.08 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.94 138.92 39.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.357 1.463 . . . . 0.0 111.054 171.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -162.21 -179.99 7.47 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -142.97 166.2 25.29 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.769 2.428 . . . . 0.0 110.574 173.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -136.31 16.32 3.2 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -147.58 171.5 15.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.327 1.051 . . . . 0.0 113.168 -170.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -137.76 14.14 2.92 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.518 1.527 . . . . 0.0 111.715 169.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.47 11.55 0.79 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.979 1.712 . . . . 0.0 114.833 -172.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.4 mt -109.79 160.39 16.38 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.707 1.139 . . . . 0.0 112.879 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 64.5 m -134.79 124.41 25.11 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 127.229 2.212 . . . . 0.0 107.604 169.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -96.42 142.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 124.675 1.19 . . . . 0.0 109.983 -175.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -139.4 155.31 47.71 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.234 1.813 . . . . 0.0 109.74 175.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.0 mp -139.21 162.24 35.47 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 121.173 -0.954 . . . . 0.0 112.718 -177.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.17 145.87 14.66 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 126.144 1.778 . . . . 0.0 110.399 169.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -72.0 -9.58 15.84 Favored 'Cis proline' 0 CA--C 1.544 1.02 0 CA-C-N 120.575 1.241 . . . . 0.0 113.284 -8.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -64.22 173.6 1.92 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.816 1.647 . . . . 0.0 113.141 171.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -127.38 137.71 31.25 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 125.214 1.405 . . . . 0.0 111.191 -169.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -78.71 59.51 7.28 Favored 'Trans proline' 0 CA--C 1.549 1.254 0 C-N-CA 124.814 3.676 . . . . 0.0 112.097 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -151.43 148.04 27.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.936 1.294 . . . . 0.0 112.429 -173.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -77.85 82.61 4.22 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.352 1.072 . . . . 0.0 113.535 -177.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 64.1 p -68.02 8.6 0.39 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.147 2.179 . . . . 0.0 114.723 169.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.7 m120 60.77 21.39 11.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.664 1.986 . . . . 0.0 114.106 -175.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -145.98 168.26 12.17 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 126.891 2.076 . . . . 0.0 109.672 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.53 149.62 56.06 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 120.931 1.088 . . . . 0.0 111.388 169.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -77.46 -60.26 2.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.19 0.996 . . . . 0.0 109.883 170.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 41.0 t -84.42 142.13 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.278 1.431 . . . . 0.0 109.504 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 75.6 t -131.0 144.27 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 110.863 175.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.7 mp -126.84 130.88 71.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 128.123 2.569 . . . . 0.0 109.342 -169.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.6 mt -94.13 157.05 16.25 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.428 0.632 . . . . 0.0 111.222 169.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.8 -24.36 56.9 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -71.49 -18.54 62.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.979 1.712 . . . . 0.0 113.468 176.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.72 6.0 62.57 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.575 1.083 . . . . 0.0 114.394 -175.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -84.35 142.4 30.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.416 1.108 . . . . 0.0 108.709 169.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.4 mm -129.27 152.73 37.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 125.882 1.673 . . . . 0.0 110.12 -168.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.4 p -55.49 118.66 19.97 Favored Pre-proline 0 N--CA 1.471 0.6 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.259 169.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -68.42 126.46 14.24 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 121.946 1.764 . . . . 0.0 111.102 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -157.13 173.64 16.68 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.755 1.222 . . . . 0.0 112.951 -175.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -133.62 149.8 51.6 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.778 0.831 . . . . 0.0 111.053 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.1 tp -139.56 120.5 14.52 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.946 2.098 . . . . 0.0 108.364 -173.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.1 tt -110.28 148.71 31.37 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.953 1.701 . . . . 0.0 110.455 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.6 mtt -126.38 134.29 51.08 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.294 1.438 . . . . 0.0 108.579 176.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -130.15 153.36 48.61 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.23 1.412 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.85 129.21 39.0 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.675 0.67 . . . . 0.0 110.022 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.56 -16.33 62.46 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -93.18 -53.86 1.82 Allowed Glycine 0 CA--C 1.533 1.189 0 C-N-CA 124.139 0.875 . . . . 0.0 113.101 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 63.1 p -79.03 -26.66 43.18 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.09 0.945 . . . . 0.0 113.283 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 76.8 3.73 80.52 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.885 1.231 . . . . 0.0 113.563 -169.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.65 131.36 61.19 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.767 1.284 . . . . 0.0 111.759 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.3 144.58 30.08 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.662 2.908 . . . . 0.0 114.273 172.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -121.71 -43.85 2.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.477 1.911 . . . . 0.0 112.071 -175.463 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 tp -155.02 156.01 35.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.874 1.67 . . . . 0.0 108.876 -172.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.5 m -141.82 148.24 38.54 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.352 1.061 . . . . 0.0 109.426 171.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 37.0 mt -122.46 140.36 52.82 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 127.557 2.343 . . . . 0.0 107.64 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.2 t -143.56 130.1 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.71 0.804 . . . . 0.0 111.786 -169.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 36.0 t -117.22 115.12 24.69 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.206 1.403 . . . . 0.0 110.94 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -74.45 -10.01 59.15 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.447 1.099 . . . . 0.0 113.952 174.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 135.73 -0.65 3.42 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.949 1.262 . . . . 0.0 115.495 178.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 72.2 m -147.35 151.89 37.29 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.147 1.474 . . . . 0.0 113.301 -171.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -60.34 135.58 91.4 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 125.469 1.508 . . . . 0.0 114.854 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -94.04 167.5 19.98 Favored 'Cis proline' 0 CA--C 1.545 1.073 0 CA-C-N 120.346 1.159 . . . . 0.0 110.398 -11.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . 0.258 0.1 OUTLIER -84.92 158.39 20.58 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.19 -0.944 . . . . 0.0 112.474 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -75.59 174.36 9.82 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.181 2.192 . . . . 0.0 113.78 -169.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -135.5 137.5 42.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.594 1.957 . . . . 0.0 110.34 169.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.8 t -152.93 162.91 40.72 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.897 1.279 . . . . 0.0 111.577 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -88.43 134.01 33.96 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 34.56 58.87 0.67 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.18 1.792 . . . . 0.0 115.086 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 62.54 11.06 4.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 127.209 2.204 . . . . 0.0 116.909 176.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.98 -29.47 63.28 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 116.292 1.96 . . . . 0.0 116.292 -169.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 81.3 p -91.92 -9.62 42.51 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.52 14.59 Favored Pre-proline 0 N--CA 1.478 0.95 0 CA-C-O 116.202 -1.856 . . . . 0.0 115.835 -174.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 C--O 1.25 1.113 0 C-N-CA 123.971 3.114 . . . . 0.0 115.18 176.776 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.791 0.329 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.25 161.82 38.64 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.153 1.381 . . . . 0.0 111.179 177.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -145.72 -2.29 0.75 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.876 1.27 . . . . 0.0 113.197 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.6 28.97 45.43 Favored Glycine 0 CA--C 1.535 1.301 0 O-C-N 121.089 -1.007 . . . . 0.0 112.037 -170.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.4 ttm-85 -144.87 -29.65 0.46 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.405 1.882 . . . . 0.0 112.815 -169.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -49.22 -39.79 31.26 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.271 2.228 . . . . 0.0 115.325 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -68.61 -39.76 80.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.865 0.757 . . . . 0.0 112.629 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.46 -41.68 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.754 0.822 . . . . 0.0 110.318 176.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -49.31 78.05 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.471 0.709 . . . . 0.0 111.903 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.24 -35.35 78.66 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.306 0.957 . . . . 0.0 112.666 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 88.4 m -61.95 -53.22 58.73 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.016 0.826 . . . . 0.0 111.219 172.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -61.17 -33.33 73.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.206 1.002 . . . . 0.0 112.885 177.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.2 90.18 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.379 1.072 . . . . 0.0 113.01 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.3 mtt-85 -63.93 -42.27 97.41 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.966 0.906 . . . . 0.0 110.841 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.8 -46.23 86.09 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.986 0.914 . . . . 0.0 112.26 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 89.1 m -59.69 -42.45 93.02 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.923 1.289 . . . . 0.0 111.252 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.71 77.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.346 1.058 . . . . 0.0 113.681 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.15 97.04 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.314 -0.866 . . . . 0.0 111.537 173.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 52.4 tpt85 -64.02 -39.33 93.85 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.324 1.05 . . . . 0.0 112.427 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.82 -43.32 93.48 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.47 1.108 . . . . 0.0 113.022 170.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 58.1 m -60.11 -43.17 95.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.228 0.611 . . . . 0.0 110.416 176.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.97 94.97 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.069 -1.019 . . . . 0.0 113.49 171.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.7 -36.38 83.46 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.181 -0.949 . . . . 0.0 113.246 176.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.6 tp -71.45 -33.64 69.53 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.418 1.087 . . . . 0.0 111.603 174.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.02 -44.46 96.67 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.055 -1.028 . . . . 0.0 111.334 169.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.5 -45.26 62.78 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.467 1.507 . . . . 0.0 111.74 169.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.7 -45.18 87.7 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 176.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 59.8 mt -61.65 -45.21 99.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.526 1.131 . . . . 0.0 110.831 177.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.02 -27.94 69.23 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.649 1.18 . . . . 0.0 113.271 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -92.78 -30.27 15.57 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.08 -29.92 67.69 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.2 t -77.72 -14.64 59.55 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 173.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.3 mt -106.14 -37.14 6.69 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.302 1.441 . . . . 0.0 113.651 -172.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.4 m -85.6 -7.91 58.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -173.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.17 -1.87 88.48 Favored Glycine 0 CA--C 1.538 1.507 0 N-CA-C 115.384 0.914 . . . . 0.0 115.384 170.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -142.15 148.36 47.87 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 127.167 2.187 . . . . 0.0 107.843 171.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -44.63 152.6 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.721 2.947 . . . . 0.0 113.942 168.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.26 161.84 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.673 1.589 . . . . 0.0 108.105 175.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -156.14 173.07 34.08 Favored Glycine 0 N--CA 1.465 0.615 0 CA-C-N 120.118 1.326 . . . . 0.0 115.473 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.9 mt -136.62 123.48 31.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 C-N-CA 124.583 1.153 . . . . 0.0 109.18 -177.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -88.92 151.73 22.15 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.882 1.673 . . . . 0.0 110.605 171.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -141.14 144.73 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.179 1.392 . . . . 0.0 112.676 -173.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.4 p -128.03 179.69 5.44 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.772 1.629 . . . . 0.0 110.589 170.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.7 1.45 12.29 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 121.313 -0.867 . . . . 0.0 113.254 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -138.27 -21.21 1.06 Allowed 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -173.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -153.33 175.82 12.67 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.061 1.345 . . . . 0.0 112.144 -178.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 26.7 p90 -139.0 147.8 42.62 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 126.006 1.722 . . . . 0.0 109.069 175.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -141.65 113.59 7.94 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.233 1.413 . . . . 0.0 111.284 -169.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.0 mt -78.57 137.53 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 24.1 mtm -134.07 155.27 50.32 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.977 1.311 . . . . 0.0 110.885 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.4 p -147.18 161.76 35.3 Favored Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.654 1.182 . . . . 0.0 110.956 -168.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -59.72 144.03 99.52 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.627 2.218 . . . . 0.0 112.567 169.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -131.44 -13.67 1.85 Allowed Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.574 1.083 . . . . 0.0 115.24 177.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -158.21 153.45 25.69 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.298 2.239 . . . . 0.0 108.803 174.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . 0.261 15.3 t 33.4 68.06 1.05 Allowed Pre-proline 0 N--CA 1.483 1.196 0 C-N-CA 126.457 1.903 . . . . 0.0 115.999 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -52.41 -24.68 22.32 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 123.09 2.527 . . . . 0.0 113.949 170.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -57.12 -14.86 4.38 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.879 2.072 . . . . 0.0 115.141 171.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -131.28 -108.91 0.26 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.374 1.469 . . . . 0.0 111.263 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 42.5 t-105 -154.05 119.59 5.19 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 125.236 1.414 . . . . 0.0 110.731 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.1 tpt85 -153.52 153.23 32.02 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.505 1.522 . . . . 0.0 110.384 173.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -136.42 147.06 47.07 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.453 1.101 . . . . 0.0 111.486 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -149.04 144.15 17.77 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 126.944 2.098 . . . . 0.0 108.363 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.66 131.75 42.8 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 122.745 2.296 . . . . 0.0 112.683 171.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.9 tp -67.54 99.06 0.72 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.853 1.261 . . . . 0.0 111.098 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -139.97 -7.08 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -171.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -55.84 -27.59 52.26 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.651 1.18 . . . . 0.0 114.142 -173.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -139.46 31.0 2.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.975 1.71 . . . . 0.0 110.897 169.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -148.61 45.15 1.03 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.849 2.46 . . . . 0.0 109.082 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.2 123.06 8.69 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.956 1.303 . . . . 0.0 112.937 -169.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.1 t70 57.66 11.21 1.22 Allowed 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 -177.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -123.32 26.98 7.7 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.408 -1.432 . . . . 0.0 113.784 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.9 p -62.66 -40.01 95.71 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.093 0.957 . . . . 0.0 112.434 169.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.16 139.96 30.62 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.333 1.053 . . . . 0.0 110.707 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -138.96 157.76 45.43 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -169.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -156.76 53.36 0.52 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.776 2.03 . . . . 0.0 110.037 -169.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 15.8 m0 -60.78 18.3 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.619 2.768 . . . . 0.0 118.358 -169.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -144.91 179.37 7.38 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.375 -1.453 . . . . 0.0 113.671 -173.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -137.23 16.82 2.98 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.51 1.524 . . . . 0.0 112.852 175.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -146.67 -1.26 0.7 Allowed 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 -169.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.8 mt -119.64 163.53 17.24 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.967 1.365 . . . . 0.0 114.436 -169.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.0 t -136.29 129.31 31.27 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 128.237 2.615 . . . . 0.0 106.949 168.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.83 137.59 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.648 1.179 . . . . 0.0 109.61 -171.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 60.2 m-70 -133.24 132.01 40.97 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.916 1.286 . . . . 0.0 109.58 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -116.85 145.23 43.69 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.691 1.196 . . . . 0.0 111.846 -169.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -145.45 151.41 47.14 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.476 1.91 . . . . 0.0 110.495 -172.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -75.92 -15.33 24.31 Favored 'Cis proline' 0 CA--C 1.543 0.953 0 CA-C-N 120.244 1.123 . . . . 0.0 112.337 -10.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -64.63 133.82 53.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.829 1.652 . . . . 0.0 111.868 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.14 147.51 90.62 Favored Pre-proline 0 CA--C 1.547 0.833 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 176.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -71.42 142.28 40.49 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.723 2.282 . . . . 0.0 109.588 169.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -154.99 -159.21 0.92 Allowed 'General case' 0 CA--C 1.549 0.936 0 O-C-N 121.507 -0.745 . . . . 0.0 112.221 -171.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -143.07 41.79 1.53 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 128.485 2.714 . . . . 0.0 108.106 168.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 34.9 t -65.9 154.49 39.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.764 2.026 . . . . 0.0 114.214 -169.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -69.98 -9.37 54.95 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.138 1.375 . . . . 0.0 113.316 169.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -126.06 161.13 53.48 Favored Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 125.046 1.339 . . . . 0.0 111.548 176.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.51 158.62 43.88 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.376 2.051 . . . . 0.0 112.062 169.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -87.94 -28.93 21.19 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.692 0.797 . . . . 0.0 111.061 169.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 89.0 t -113.21 134.74 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.994 1.317 . . . . 0.0 109.826 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 87.6 t -133.0 140.79 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.408 1.083 . . . . 0.0 110.775 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 4.8 mp -118.7 120.23 63.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 127.304 2.241 . . . . 0.0 108.652 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.5 mt -89.21 158.65 17.8 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 122.129 0.966 . . . . 0.0 111.742 176.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.17 -23.0 53.78 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -106.77 7.39 30.31 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.726 1.211 . . . . 0.0 113.932 -172.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 100.01 12.4 39.96 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 115.559 0.984 . . . . 0.0 115.559 172.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.54 ' C ' HD12 ' A' ' 105' ' ' ILE . 10.7 pt20 -98.78 140.34 33.11 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.614 1.207 . . . . 0.0 109.848 169.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.54 HD12 ' C ' ' A' ' 104' ' ' GLN . 2.9 mp -133.76 143.83 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.757 1.623 . . . . 0.0 108.068 -169.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 p -50.16 123.15 15.81 Favored Pre-proline 0 N--CA 1.475 0.779 0 C-N-CA 124.328 1.051 . . . . 0.0 111.613 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.76 123.5 13.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.675 2.25 . . . . 0.0 112.929 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.472 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.2 p90 -152.21 174.24 14.0 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.388 1.475 . . . . 0.0 111.36 176.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 65.7 m -145.94 146.57 31.1 Favored 'General case' 0 C--N 1.33 -0.251 0 O-C-N 121.307 -0.871 . . . . 0.0 111.373 172.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.2 tp -129.2 124.47 34.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 127.641 2.377 . . . . 0.0 108.392 -169.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.7 tt -120.19 144.86 47.48 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.492 1.117 . . . . 0.0 110.118 -177.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.1 mtt -123.06 129.99 52.2 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 109.629 -178.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.11 138.68 52.62 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.187 1.395 . . . . 0.0 111.088 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -57.92 123.62 16.43 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.989 1.316 . . . . 0.0 111.535 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.17 -17.81 54.92 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -116.82 -45.03 0.56 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.09 1.329 . . . . 0.0 113.943 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.0 m -73.3 -25.65 60.74 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.679 1.239 . . . . 0.0 112.338 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 73.9 33.35 57.68 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.022 0.82 . . . . 0.0 113.984 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -136.71 139.59 29.55 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.287 1.435 . . . . 0.0 111.375 -169.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -52.14 146.57 30.19 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.942 3.095 . . . . 0.0 114.626 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -141.07 -8.71 1.02 Allowed 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.448 HD21 HE21 ' A' ' 134' ' ' GLN . 7.0 tp -163.07 152.71 15.42 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.42 1.488 . . . . 0.0 110.308 175.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 1.1 m -139.71 146.24 39.35 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.642 1.577 . . . . 0.0 108.781 169.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.59 139.17 53.82 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.745 2.418 . . . . 0.0 108.829 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.9 t -137.01 128.44 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.46 0.704 . . . . 0.0 112.328 -170.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.472 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 52.7 t -105.64 109.41 21.36 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.305 1.442 . . . . 0.0 109.977 172.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 63.7 p -74.04 -17.35 60.98 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 173.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 143.58 -8.12 2.03 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 125.068 1.318 . . . . 0.0 115.034 -177.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 88.5 p -153.99 161.05 42.25 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.214 1.507 . . . . 0.0 113.899 -177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -61.73 137.89 95.19 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 125.95 1.7 . . . . 0.0 115.533 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -94.64 177.67 10.75 Favored 'Cis proline' 0 CA--C 1.547 1.157 0 CA-C-N 120.032 1.047 . . . . 0.0 110.513 -11.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.32 153.88 41.48 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.073 -1.017 . . . . 0.0 111.757 171.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -88.26 161.39 17.21 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.372 1.469 . . . . 0.0 109.505 169.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.448 HE21 HD21 ' A' ' 122' ' ' LEU . 55.5 tt0 -138.26 140.63 39.72 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.621 1.568 . . . . 0.0 111.247 -169.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 2.4 t -150.36 157.46 43.07 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.81 2.044 . . . . 0.0 109.703 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -82.57 -12.31 57.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 176.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -169.56 65.94 0.05 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.152 1.381 . . . . 0.0 114.044 -173.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.07 12.31 2.37 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 116.904 2.187 . . . . 0.0 116.904 171.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -61.23 -28.9 69.49 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 120.715 1.598 . . . . 0.0 113.822 -177.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 36.0 p -89.18 3.37 52.15 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.059 1.744 . . . . 0.0 113.743 175.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -115.85 85.15 14.05 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 125.99 1.716 . . . . 0.0 111.399 -170.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--O 1.25 1.091 0 C-N-CA 123.07 2.514 . . . . 0.0 112.093 172.099 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mtp . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.66 12.7 1.54 Allowed 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 114.95 1.463 . . . . 0.0 114.95 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.0 p90 -154.47 177.84 10.73 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.765 1.626 . . . . 0.0 112.054 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 104.72 8.46 37.19 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.98 1.276 . . . . 0.0 114.456 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 30.2 ptt-85 -150.93 52.68 0.86 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.848 2.059 . . . . 0.0 111.414 -170.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -50.85 -35.25 31.52 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.978 1.311 . . . . 0.0 114.073 -173.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.49 -33.8 75.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 39.0 t -73.58 -44.08 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.843 0.857 . . . . 0.0 110.199 175.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.17 -43.55 95.75 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 118.772 0.714 . . . . 0.0 111.904 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -56.58 -48.85 76.48 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.072 1.349 . . . . 0.0 112.509 170.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.901 0.481 . . . . 0.0 110.713 176.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -59.09 -40.98 86.96 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.262 -0.875 . . . . 0.0 112.66 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.67 83.69 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.955 1.252 . . . . 0.0 111.886 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -68.32 -39.38 82.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.454 1.102 . . . . 0.0 111.457 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.57 -44.57 90.28 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.121 0.568 . . . . 0.0 112.219 171.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.1 m -60.08 -38.63 83.47 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.866 1.267 . . . . 0.0 111.589 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.96 -44.25 81.0 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 173.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.5 98.64 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 121.349 -0.844 . . . . 0.0 112.034 174.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -60.84 -47.72 85.07 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.834 1.254 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -58.59 -43.39 89.49 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 174.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 33.1 m -57.84 -43.01 85.58 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.06 0.845 . . . . 0.0 111.021 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.32 89.33 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.882 -1.136 . . . . 0.0 113.722 172.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.84 -31.2 71.66 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.972 -1.08 . . . . 0.0 113.46 176.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 tp -70.23 -35.98 74.22 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.376 1.07 . . . . 0.0 111.498 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.43 -44.73 95.72 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.12 -0.987 . . . . 0.0 111.653 170.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 tp -53.67 -48.1 69.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.614 1.166 . . . . 0.0 111.393 169.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.84 -38.48 85.63 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.9 mt -64.95 -46.21 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.953 0.901 . . . . 0.0 110.935 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.81 -40.89 89.89 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.8 -0.563 . . . . 0.0 112.115 175.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.0 mmt85 -67.31 -41.61 85.06 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.464 -0.772 . . . . 0.0 112.398 173.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.07 -38.11 87.57 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.948 1.249 . . . . 0.0 112.605 176.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.38 -24.19 50.63 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.959 -0.463 . . . . 0.0 112.17 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -32.92 17.71 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.08 0.952 . . . . 0.0 113.122 177.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 60.9 m -79.99 -21.45 43.62 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -169.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.54 8.5 87.61 Favored Glycine 0 CA--C 1.541 1.709 0 CA-C-N 118.82 0.736 . . . . 0.0 114.616 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -144.99 149.06 41.03 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 127.584 2.354 . . . . 0.0 107.595 171.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.06 160.3 0.29 Allowed 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.485 2.79 . . . . 0.0 113.719 168.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.1 t -127.56 162.24 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 126.629 1.971 . . . . 0.0 109.099 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -151.58 178.64 28.78 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 115.216 0.846 . . . . 0.0 115.216 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -133.59 116.63 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.793 1.237 . . . . 0.0 109.358 -172.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -85.36 68.46 10.48 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.877 2.071 . . . . 0.0 110.851 -176.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -61.65 153.1 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.716 0.806 . . . . 0.0 113.075 169.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 p -139.37 -177.05 4.75 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.308 2.243 . . . . 0.0 109.77 169.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -57.76 -21.98 44.43 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 173.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m -138.39 -4.08 1.68 Allowed 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -171.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.42 176.17 10.24 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 122.361 1.077 . . . . 0.0 113.409 -176.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -154.55 161.58 41.56 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.821 2.448 . . . . 0.0 108.49 177.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -174.7 148.33 1.12 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.741 2.016 . . . . 0.0 109.879 169.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.6 mm -73.29 147.23 9.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.058 0.543 . . . . 0.0 109.756 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 61.6 mtp -128.65 134.58 48.57 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.094 1.358 . . . . 0.0 108.804 169.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -134.71 160.04 69.91 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 125.39 1.476 . . . . 0.0 109.878 -168.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -63.39 -24.78 71.13 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.25 1.967 . . . . 0.0 115.135 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.91 -52.76 0.05 OUTLIER Glycine 0 CA--C 1.54 1.608 0 C-N-CA 129.219 3.295 . . . . 0.0 116.738 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -144.03 -18.11 0.58 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 128.164 2.586 . . . . 0.0 112.689 -177.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 p -131.1 69.59 82.41 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 125.099 1.36 . . . . 0.0 113.161 -169.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -71.0 27.77 0.21 Allowed 'Trans proline' 0 CA--C 1.55 1.305 0 C-N-CA 124.974 3.783 . . . . 0.0 113.763 173.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.7 m -71.14 -35.19 71.6 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.073 1.749 . . . . 0.0 113.932 -170.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -173.22 -44.55 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.631 1.572 . . . . 0.0 112.98 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -148.53 -66.76 0.23 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.174 0.99 . . . . 0.0 112.67 -172.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -12.41 87.73 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 129.226 3.01 . . . . 0.0 115.547 -172.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 62.6 m95 -73.69 161.03 30.71 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 36.0 t -139.72 134.48 16.12 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 128.022 2.529 . . . . 0.0 107.205 170.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -65.04 133.58 36.25 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.049 1.833 . . . . 0.0 110.167 174.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 tt -76.46 82.02 3.17 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.802 0.811 . . . . 0.0 111.075 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -132.21 17.82 4.5 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.325 1.85 . . . . 0.0 112.584 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -58.66 -24.04 60.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.746 1.218 . . . . 0.0 114.088 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -145.43 -33.31 0.36 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.731 1.613 . . . . 0.0 112.36 173.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.9 28.36 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.989 1.715 . . . . 0.0 113.922 169.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.6 -25.55 10.96 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.617 1.967 . . . . 0.0 116.101 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -132.05 18.41 4.55 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.063 1.745 . . . . 0.0 112.603 175.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -136.86 -2.01 2.16 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.505 1.522 . . . . 0.0 113.617 -173.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 79.7 p -65.12 -14.32 60.26 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -176.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -135.11 162.25 33.02 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.752 1.221 . . . . 0.0 113.997 -172.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . 0.289 48.2 t-20 40.75 -114.57 0.21 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.945 2.098 . . . . 0.0 113.434 -168.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.5 t70 56.34 8.07 0.39 Allowed 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 125.906 1.683 . . . . 0.0 114.825 -169.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 49.8 m0 -115.42 -33.76 5.16 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.621 -1.3 . . . . 0.0 112.935 -170.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 169.07 23.32 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -142.03 25.5 1.93 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.987 1.715 . . . . 0.0 111.097 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -143.33 -1.62 1.03 Allowed 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -169.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 52.0 mt -117.06 165.24 13.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -169.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -133.94 131.43 39.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 128.794 2.838 . . . . 0.0 107.341 169.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -103.37 142.47 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 124.817 1.247 . . . . 0.0 109.468 -174.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -139.24 149.38 44.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.581 1.552 . . . . 0.0 109.547 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 83.9 mt -132.42 160.46 36.32 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.014 0.925 . . . . 0.0 112.727 -171.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.55 142.83 13.11 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.823 1.649 . . . . 0.0 110.029 169.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -73.19 -8.28 18.15 Favored 'Cis proline' 0 CA--C 1.547 1.155 0 CA-C-N 120.419 1.185 . . . . 0.0 113.516 -9.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -64.48 173.68 2.01 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.133 1.773 . . . . 0.0 112.891 174.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -118.16 134.39 23.36 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.228 1.411 . . . . 0.0 112.224 -175.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -78.59 74.25 5.53 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 124.123 3.215 . . . . 0.0 111.256 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -136.42 144.87 44.71 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.573 1.149 . . . . 0.0 111.567 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -76.34 56.17 1.05 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 125.351 1.461 . . . . 0.0 111.627 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.7 p -65.51 -6.46 10.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 128.479 2.712 . . . . 0.0 117.083 -169.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.68 26.08 15.84 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 113.97 -170.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -142.66 165.59 25.78 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 125.546 1.538 . . . . 0.0 109.775 169.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -65.96 142.74 69.91 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 121.437 1.425 . . . . 0.0 113.226 171.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.31 -13.22 18.91 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.851 2.061 . . . . 0.0 112.297 169.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -133.36 141.16 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.154 1.782 . . . . 0.0 108.019 173.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.4 t -133.18 144.26 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.487 1.115 . . . . 0.0 110.815 -174.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -130.2 121.16 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 127.948 2.499 . . . . 0.0 108.934 -169.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.5 157.81 31.8 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.988 1.315 . . . . 0.0 111.236 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.79 -7.81 5.69 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -178.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -115.56 8.31 15.09 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.724 1.61 . . . . 0.0 112.989 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 89.35 8.96 67.66 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 115.321 0.888 . . . . 0.0 115.321 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -78.84 144.4 35.05 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 169.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.3 mm -130.79 126.8 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.289 1.036 . . . . 0.0 108.763 -169.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 79.1 m -57.71 113.16 5.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -178.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -50.74 133.55 39.27 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 124.174 3.25 . . . . 0.0 115.839 -170.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.408 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 9.9 p90 -165.23 176.69 8.19 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.761 2.025 . . . . 0.0 111.4 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.0 t -141.15 146.15 36.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.633 1.173 . . . . 0.0 109.216 168.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tp -131.11 120.78 23.86 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 126.72 2.008 . . . . 0.0 108.704 -169.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.5 tt -112.11 148.34 34.17 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.485 1.514 . . . . 0.0 110.047 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 70.5 mtm -132.12 137.73 47.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.349 1.06 . . . . 0.0 109.372 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.42 155.89 49.82 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.94 1.696 . . . . 0.0 110.184 -173.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -63.3 132.75 52.61 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 119.009 0.822 . . . . 0.0 110.327 173.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.21 -33.07 67.14 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -175.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -90.36 -47.44 3.79 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 119.016 0.825 . . . . 0.0 114.314 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.5 p -80.35 -28.05 38.17 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 72.81 7.57 70.33 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.887 0.756 . . . . 0.0 112.939 -169.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -71.15 128.22 90.65 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.969 1.307 . . . . 0.0 110.494 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.51 149.49 87.66 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.544 2.163 . . . . 0.0 112.008 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -124.25 -47.95 1.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.808 1.643 . . . . 0.0 111.884 -172.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.46 HD23 ' N ' ' A' ' 123' ' ' THR . 5.3 tt -153.31 149.0 27.43 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.391 1.476 . . . . 0.0 108.799 -169.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.46 ' N ' HD23 ' A' ' 122' ' ' LEU . 8.0 m -139.88 143.62 36.79 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.964 0.906 . . . . 0.0 110.085 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.3 mt -122.78 148.0 45.87 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 127.047 2.139 . . . . 0.0 108.675 -178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.7 t -142.84 135.86 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.284 0.634 . . . . 0.0 111.788 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.408 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 30.7 t -113.83 151.57 31.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.925 1.29 . . . . 0.0 111.581 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.2 p -128.64 -0.44 5.49 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.758 1.623 . . . . 0.0 113.787 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 132.24 -13.1 5.21 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.819 1.199 . . . . 0.0 115.381 176.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 8.6 t -153.04 156.07 38.06 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.478 1.639 . . . . 0.0 113.48 -174.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -55.98 137.99 72.46 Favored Pre-proline 0 CA--C 1.552 1.047 0 C-N-CA 126.738 2.015 . . . . 0.0 115.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -96.17 178.39 8.69 Favored 'Cis proline' 0 CA--C 1.55 1.283 0 CA-C-N 120.099 1.071 . . . . 0.0 110.793 -11.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.03 159.61 30.43 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.041 -1.037 . . . . 0.0 112.159 169.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -90.8 168.43 11.73 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.881 1.672 . . . . 0.0 109.902 169.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.455 ' HG3' HD21 ' A' ' 122' ' ' LEU . 56.1 tt0 -143.79 141.88 30.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.254 1.821 . . . . 0.0 111.847 -169.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 12.2 t -153.72 162.8 40.93 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.275 1.43 . . . . 0.0 111.116 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -84.75 137.12 33.39 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.593 -0.692 . . . . 0.0 109.155 170.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 23.87 65.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 127.556 2.342 . . . . 0.0 116.317 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 58.3 mtm180 57.25 9.67 0.74 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 118.043 2.608 . . . . 0.0 118.043 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -56.78 -20.73 23.94 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.467 1.485 . . . . 0.0 114.948 -175.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.83 12.29 6.23 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.596 1.558 . . . . 0.0 113.052 175.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 13.7 ttp180 -74.74 135.27 74.78 Favored Pre-proline 0 N--CA 1.482 1.128 0 O-C-N 120.442 -1.412 . . . . 0.0 110.032 176.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 C--O 1.249 1.069 0 C-N-CA 122.935 2.423 . . . . 0.0 113.318 171.188 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 110.512 -0.181 . . . . 0.0 110.512 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.31 166.49 29.83 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.972 1.309 . . . . 0.0 111.965 178.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.4 p90 -63.04 -28.85 70.38 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.946 1.298 . . . . 0.0 113.988 176.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 167.54 -178.79 41.36 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.17 1.367 . . . . 0.0 112.435 -175.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -145.29 136.02 24.46 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.209 1.403 . . . . 0.0 111.435 176.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -80.39 -26.91 38.31 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -171.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -67.8 -45.51 74.59 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.889 0.875 . . . . 0.0 112.602 -176.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.8 t -63.59 -46.03 96.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.564 0.745 . . . . 0.0 110.44 173.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.06 78.99 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.481 0.582 . . . . 0.0 112.329 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.75 -42.85 97.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.279 0.945 . . . . 0.0 111.992 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.5 m -60.62 -46.95 88.35 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.601 1.091 . . . . 0.0 111.402 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -61.31 -36.07 79.12 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.303 -0.856 . . . . 0.0 112.474 172.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.5 88.19 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.68 1.127 . . . . 0.0 112.763 175.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -61.74 -41.28 97.44 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.497 0.719 . . . . 0.0 111.271 178.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -64.73 -52.74 55.5 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.018 0.527 . . . . 0.0 111.945 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 96.5 m -52.82 -41.02 63.81 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.382 1.473 . . . . 0.0 111.559 177.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.72 -48.22 69.9 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.711 1.205 . . . . 0.0 113.593 172.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.93 -42.46 94.01 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.663 0.665 . . . . 0.0 112.34 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -68.52 -38.01 80.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.165 0.586 . . . . 0.0 111.226 175.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -58.71 -43.85 90.2 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.055 -0.974 . . . . 0.0 112.724 172.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -44.31 83.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.642 1.564 . . . . 0.0 111.988 173.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.05 -39.7 94.65 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.349 0.977 . . . . 0.0 113.099 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.96 78.57 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.089 0.956 . . . . 0.0 113.25 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.54 -36.9 71.14 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 0.0 111.359 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -62.52 -44.27 96.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.963 -1.085 . . . . 0.0 111.533 169.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.0 tp -53.07 -45.92 68.35 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.198 1.399 . . . . 0.0 111.419 169.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.23 -42.04 98.95 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 176.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 75.2 mt -61.89 -47.14 94.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.877 0.871 . . . . 0.0 110.528 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -61.82 -34.08 75.3 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.867 0.867 . . . . 0.0 113.019 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.0 ttt85 -79.05 -35.05 43.18 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.667 0.787 . . . . 0.0 113.023 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.34 -25.1 67.71 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -176.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.0 t -77.55 -14.29 59.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 171.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 76.8 mt -108.01 -30.88 8.21 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.009 1.723 . . . . 0.0 113.09 -173.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.8 p -69.23 -29.79 67.81 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.548 1.939 . . . . 0.0 115.088 -176.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.99 83.04 Favored Glycine 0 CA--C 1.542 1.729 0 C-N-CA 124.895 1.236 . . . . 0.0 114.875 -176.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -145.42 145.76 27.45 Favored Pre-proline 0 N--CA 1.471 0.584 0 C-N-CA 127.247 2.219 . . . . 0.0 107.985 171.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -40.73 139.01 1.38 Allowed 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.275 2.65 . . . . 0.0 112.955 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 75.5 t -91.13 162.7 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.47 1.508 . . . . 0.0 108.786 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -146.82 169.41 27.95 Favored Glycine 0 CA--C 1.521 0.447 0 O-C-N 120.914 -1.116 . . . . 0.0 114.637 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.7 mt -136.06 116.6 18.08 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 125.001 1.32 . . . . 0.0 107.5 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -78.6 153.61 30.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.958 1.303 . . . . 0.0 110.688 170.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -141.2 142.54 33.98 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.254 1.822 . . . . 0.0 111.303 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.5 t -144.34 175.53 10.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.997 1.719 . . . . 0.0 111.26 -176.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -49.07 -29.77 5.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.501 1.921 . . . . 0.0 115.816 -169.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 82.4 p -140.97 14.62 2.27 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.023 1.329 . . . . 0.0 113.586 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.08 171.66 17.52 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.759 1.266 . . . . 0.0 114.355 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -138.28 160.26 39.93 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 127.771 2.428 . . . . 0.0 107.868 169.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -154.19 125.5 7.42 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.797 1.239 . . . . 0.0 110.885 -176.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 16.9 mm -72.82 142.42 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.207 -178.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.1 mtp -137.15 151.2 48.54 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.801 1.241 . . . . 0.0 112.25 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -145.45 167.94 13.18 Favored Pre-proline 0 N--CA 1.478 0.948 0 C-N-CA 126.248 1.819 . . . . 0.0 111.277 -169.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -60.79 -23.82 77.46 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.184 2.589 . . . . 0.0 115.866 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.12 -145.32 49.05 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 121.631 -0.668 . . . . 0.0 111.858 -169.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -73.21 1.15 9.88 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 116.635 2.087 . . . . 0.0 116.635 -174.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.6 p -125.47 38.73 0.42 Allowed Pre-proline 0 N--CA 1.485 1.309 0 N-CA-C 115.348 1.61 . . . . 0.0 115.348 -171.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -61.56 -15.07 39.1 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.098 2.532 . . . . 0.0 115.282 -169.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.4 m -60.88 -15.21 28.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.455 1.502 . . . . 0.0 114.45 169.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -145.03 166.91 23.97 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.901 1.68 . . . . 0.0 111.9 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -63.62 117.91 7.48 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.052 0.941 . . . . 0.0 111.897 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -154.05 160.11 41.85 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.651 1.58 . . . . 0.0 110.528 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -139.79 142.92 36.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.665 1.186 . . . . 0.0 112.52 174.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -150.83 145.14 17.92 Favored Pre-proline 0 N--CA 1.47 0.561 0 C-N-CA 126.099 1.759 . . . . 0.0 109.126 169.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.22 147.18 36.51 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.511 2.141 . . . . 0.0 111.794 169.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.68 12.72 0.12 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -178.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -61.62 -18.41 59.33 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.175 -1.578 . . . . 0.0 113.698 -175.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.44 -18.85 65.64 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -145.83 -16.07 0.47 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -120.43 13.58 11.84 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.04 1.336 . . . . 0.0 112.264 169.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 53.41 -168.64 0.06 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.636 2.375 . . . . 0.0 114.443 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -55.47 -16.6 3.92 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.291 -1.505 . . . . 0.0 113.967 173.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.35 3.15 9.57 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.754 2.021 . . . . 0.0 113.858 174.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -62.54 16.74 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.793 2.037 . . . . 0.0 115.367 174.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -146.73 175.18 10.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.005 1.722 . . . . 0.0 114.305 -169.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -51.48 134.2 29.18 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -173.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -150.87 16.67 0.77 Allowed 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 127.116 2.166 . . . . 0.0 111.44 169.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -88.83 -9.36 51.99 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 -169.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.7 171.79 13.58 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 -172.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -136.53 9.52 3.15 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.374 1.87 . . . . 0.0 112.301 175.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -157.15 15.8 0.27 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -169.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 68.7 mt -110.66 152.96 25.89 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.251 -1.531 . . . . 0.0 114.102 -177.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 26.7 t -131.23 134.94 46.93 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.769 2.827 . . . . 0.0 106.779 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -112.12 139.07 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 125.311 1.445 . . . . 0.0 110.323 -169.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -139.14 123.31 18.0 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.163 1.385 . . . . 0.0 110.747 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.8 mp -106.25 157.22 17.75 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.33 1.062 . . . . 0.0 112.739 -177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.92 126.66 7.27 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.775 2.03 . . . . 0.0 108.846 -174.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -75.99 -9.28 27.14 Favored 'Cis proline' 0 CA--C 1.547 1.149 0 CA-C-N 120.333 1.155 . . . . 0.0 113.605 -8.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -70.29 152.15 44.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.248 1.419 . . . . 0.0 113.972 -170.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.54 120.94 80.51 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.249 1.42 . . . . 0.0 113.453 179.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -79.68 63.12 8.7 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.3 3.333 . . . . 0.0 111.098 170.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -157.86 154.19 27.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.0 1.72 . . . . 0.0 110.515 -174.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -56.26 66.18 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.837 2.855 . . . . 0.0 116.925 -173.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.9 t -62.9 158.33 19.35 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.851 2.06 . . . . 0.0 113.479 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -71.07 -7.01 43.52 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.168 1.387 . . . . 0.0 113.46 171.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -136.44 161.76 60.25 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 125.748 1.619 . . . . 0.0 111.449 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.71 142.86 44.76 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 121.628 1.552 . . . . 0.0 110.17 168.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -72.44 -22.55 61.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.471 1.109 . . . . 0.0 112.31 174.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.5 t -123.17 135.46 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.031 1.333 . . . . 0.0 109.989 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 91.9 t -131.03 144.14 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.584 1.154 . . . . 0.0 110.526 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.3 mp -128.54 123.53 59.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 127.5 2.32 . . . . 0.0 110.184 -169.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.8 mt -83.16 160.82 21.75 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.082 0.944 . . . . 0.0 112.368 175.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.14 62.81 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.899 1.279 . . . . 0.0 113.604 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -93.72 16.17 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.201 1.801 . . . . 0.0 112.555 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 68.97 11.62 63.67 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.658 -1.276 . . . . 0.0 115.279 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.69 143.66 34.4 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 169.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 4.7 mm -132.84 143.41 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 125.193 1.397 . . . . 0.0 108.847 -171.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.1 p -53.07 127.84 46.83 Favored Pre-proline 0 N--CA 1.471 0.582 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.252 170.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.63 127.55 12.53 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.356 2.038 . . . . 0.0 111.344 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.53 ' H ' ' HB3' ' A' ' 126' ' ' CYS . 6.2 p90 -160.31 173.76 15.2 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.236 2.214 . . . . 0.0 110.433 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.2 m -135.2 145.88 48.13 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.69 0.796 . . . . 0.0 110.894 169.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -135.52 113.8 11.47 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.692 1.997 . . . . 0.0 108.997 -169.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 9.7 tt -104.53 146.16 29.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.611 1.564 . . . . 0.0 110.159 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 66.8 mtt -119.11 133.39 55.82 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.955 1.302 . . . . 0.0 109.595 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -131.14 139.95 49.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.513 1.525 . . . . 0.0 111.001 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 34.8 t-20 -57.35 119.44 6.47 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.127 1.371 . . . . 0.0 111.259 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.22 -17.63 58.83 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -108.86 -47.21 0.91 Allowed Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.657 1.122 . . . . 0.0 113.395 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.8 m -76.63 -23.63 53.36 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.978 0.911 . . . . 0.0 112.916 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 71.08 37.0 64.13 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.41 1.005 . . . . 0.0 113.858 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -137.83 136.5 20.0 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 125.203 1.401 . . . . 0.0 111.364 -169.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -53.49 149.51 30.47 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.156 3.238 . . . . 0.0 115.184 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -142.65 -10.72 0.81 Allowed 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 176.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.2 tp -167.68 157.14 10.09 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.459 1.904 . . . . 0.0 109.336 178.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 19.5 m -145.81 150.19 35.73 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.759 1.224 . . . . 0.0 109.114 169.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.33 138.09 54.63 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 127.369 2.268 . . . . 0.0 108.569 -178.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 60.0 t -134.72 136.58 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.032 0.933 . . . . 0.0 111.322 -169.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.53 ' HB3' ' H ' ' A' ' 108' ' ' PHE . 36.9 t -120.73 149.6 42.27 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.023 1.729 . . . . 0.0 111.337 177.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 80.3 p -130.06 0.77 4.73 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.432 1.493 . . . . 0.0 114.276 -177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 136.52 -11.43 4.04 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.456 1.027 . . . . 0.0 115.46 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 89.3 p -156.62 160.29 39.26 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 119.039 1.42 . . . . 0.0 114.022 -172.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 48.7 t-105 -57.39 137.72 81.34 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.832 1.653 . . . . 0.0 114.759 177.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -98.51 176.36 7.94 Favored 'Cis proline' 0 CA--C 1.549 1.232 0 CA-C-N 120.155 1.091 . . . . 0.0 111.376 -10.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.9 mp -71.35 165.13 24.38 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.168 -0.957 . . . . 0.0 110.823 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -120.33 135.48 55.0 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.15 1.38 . . . . 0.0 111.663 -176.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -88.49 149.91 23.4 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.173 1.389 . . . . 0.0 112.054 -177.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 11.1 t -153.59 170.42 20.86 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.386 1.874 . . . . 0.0 110.66 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.8 mp -101.43 136.77 40.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.111 0.964 . . . . 0.0 108.83 169.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 35.94 54.82 0.96 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.339 1.856 . . . . 0.0 114.81 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . 0.264 51.2 ptt85 43.52 33.82 0.7 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.106 2.563 . . . . 0.0 117.015 -177.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.28 -31.5 67.53 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 59.7 p -79.7 -5.18 54.67 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 172.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -137.4 75.76 44.79 Favored Pre-proline 0 N--CA 1.476 0.833 0 C-N-CA 125.614 1.566 . . . . 0.0 112.311 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo . . . . . 0 C--O 1.25 1.115 0 C-N-CA 124.661 3.574 . . . . 0.0 114.293 169.628 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttm . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 110.528 -0.175 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.31 167.05 23.37 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.183 1.393 . . . . 0.0 111.51 178.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -131.59 5.92 4.37 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -169.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.8 50.8 3.35 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 126.236 1.874 . . . . 0.0 114.819 -172.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -132.2 56.46 1.83 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.003 1.721 . . . . 0.0 110.918 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.66 -33.5 4.3 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.285 1.434 . . . . 0.0 114.113 170.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.37 -48.93 65.29 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.934 1.694 . . . . 0.0 113.804 171.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.4 t -73.72 -45.84 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-O 118.6 -0.714 . . . . 0.0 109.948 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.21 -44.38 83.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.607 1.094 . . . . 0.0 112.673 -178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -62.49 -44.25 96.83 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.082 -1.011 . . . . 0.0 111.93 174.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 85.2 m -57.53 -50.5 72.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.012 0.525 . . . . 0.0 111.111 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -62.54 -37.44 86.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.193 0.997 . . . . 0.0 112.61 177.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.01 -46.47 89.37 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.128 0.876 . . . . 0.0 111.333 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.74 -37.41 82.12 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.487 1.115 . . . . 0.0 111.885 -178.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -66.08 -46.9 76.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.427 0.691 . . . . 0.0 112.442 171.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 62.7 m -63.07 -35.72 81.18 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.364 1.065 . . . . 0.0 111.281 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.54 -41.53 79.73 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.128 1.371 . . . . 0.0 113.685 172.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.83 99.3 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.349 -0.844 . . . . 0.0 111.44 172.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -63.24 -42.55 99.23 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.583 0.753 . . . . 0.0 112.326 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -60.84 -42.31 97.52 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.888 0.767 . . . . 0.0 112.397 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.0 m -60.61 -44.2 96.56 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.419 0.688 . . . . 0.0 110.723 176.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.93 -40.11 95.71 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.93 -1.106 . . . . 0.0 113.418 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.61 78.8 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.179 -0.951 . . . . 0.0 112.927 175.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.6 tp -71.3 -34.68 70.83 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.701 1.2 . . . . 0.0 112.038 172.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.1 -44.36 95.92 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.911 -1.118 . . . . 0.0 111.581 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.5 -44.7 62.59 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.438 1.495 . . . . 0.0 111.592 169.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.68 -42.99 97.97 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 175.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.46 -44.45 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 119.146 0.884 . . . . 0.0 110.758 175.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.21 -14.94 29.25 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.979 1.312 . . . . 0.0 113.795 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -112.09 -25.66 9.23 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 176.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.2 -29.6 69.92 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.062 1.301 . . . . 0.0 112.748 170.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -68.52 -19.15 64.5 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 173.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 pp -117.45 -24.67 7.26 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -169.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.8 m -86.22 -12.92 48.39 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -172.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.81 1.82 89.83 Favored Glycine 0 CA--C 1.539 1.562 0 N-CA-C 115.185 0.834 . . . . 0.0 115.185 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -146.8 148.76 34.15 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 127.733 2.413 . . . . 0.0 107.424 171.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -44.96 147.58 1.91 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.078 2.519 . . . . 0.0 112.868 168.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.8 t -104.48 165.23 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 126.144 1.778 . . . . 0.0 108.411 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -152.28 176.25 30.62 Favored Glycine 0 CA--C 1.522 0.483 0 O-C-N 120.629 -1.295 . . . . 0.0 115.479 -177.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 15.4 mt -133.81 121.04 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 C-N-CA 125.145 1.378 . . . . 0.0 108.256 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -86.29 148.39 25.64 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.791 1.236 . . . . 0.0 110.482 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -134.84 149.0 50.28 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.88 1.672 . . . . 0.0 112.682 -176.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.6 t -146.0 -179.02 6.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.619 2.368 . . . . 0.0 110.105 177.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -58.22 -30.42 66.47 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 -169.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.8 m -138.48 4.54 2.4 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.823 1.249 . . . . 0.0 113.801 -179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -152.22 168.72 24.46 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.072 -1.017 . . . . 0.0 112.959 -173.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 17.8 p90 -157.06 161.85 39.48 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.737 2.015 . . . . 0.0 109.397 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 47.1 ttm-85 -155.04 145.95 22.54 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.103 1.361 . . . . 0.0 110.755 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.1 mm -64.17 146.24 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.48 1.112 . . . . 0.0 110.746 171.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 93.9 mtp -135.19 150.85 50.2 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.884 1.674 . . . . 0.0 110.701 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.7 m -142.16 161.81 48.76 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 125.82 1.648 . . . . 0.0 111.387 -170.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.03 -13.11 25.77 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.023 3.148 . . . . 0.0 116.926 -178.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 35.41 -96.83 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 C-N-CA 127.28 2.371 . . . . 0.0 116.287 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 mmmt -68.15 -29.01 67.81 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 t -168.57 123.4 0.76 Allowed Pre-proline 0 N--CA 1.477 0.88 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -77.15 -20.76 12.57 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.529 2.819 . . . . 0.0 112.25 169.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 t -76.25 -28.79 57.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.749 1.219 . . . . 0.0 112.796 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -130.99 17.23 5.1 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 51.9 t-105 60.82 76.51 0.37 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.726 2.01 . . . . 0.0 113.425 169.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.94 59.67 1.67 Allowed 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.928 -1.107 . . . . 0.0 112.667 -177.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -44.49 149.4 0.39 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.503 1.921 . . . . 0.0 115.509 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.0 m -142.02 157.15 64.59 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 126.125 1.77 . . . . 0.0 111.163 170.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.56 129.05 21.45 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.815 2.343 . . . . 0.0 109.967 169.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 57.4 tp -74.63 113.11 11.51 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.82 -0.55 . . . . 0.0 109.896 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -138.22 2.5 2.31 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.079 0.952 . . . . 0.0 112.628 169.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.75 -31.2 25.68 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.605 1.962 . . . . 0.0 115.616 -169.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -136.02 26.54 3.27 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.128 1.371 . . . . 0.0 112.029 177.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -130.27 -12.9 3.99 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.359 1.464 . . . . 0.0 113.222 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.03 -52.92 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 129.717 3.207 . . . . 0.0 114.846 -170.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -152.11 -14.21 0.18 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.723 2.409 . . . . 0.0 113.636 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.94 -1.25 3.8 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.276 -1.515 . . . . 0.0 114.19 -172.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 97.2 p -67.93 -16.33 64.02 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.732 1.613 . . . . 0.0 114.133 170.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -84.49 -173.31 4.65 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 175.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -68.75 -119.4 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 125.493 1.517 . . . . 0.0 114.345 175.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.8 t70 60.6 16.78 6.83 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 125.758 1.623 . . . . 0.0 112.623 -167.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . . . . . . . . . 30.8 m0 -77.1 -15.1 59.69 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.774 1.63 . . . . 0.0 113.348 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -141.32 166.64 24.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.538 1.535 . . . . 0.0 114.493 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.68 -33.21 0.26 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 127.688 2.395 . . . . 0.0 112.116 -176.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -87.92 1.4 54.16 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.028 1.331 . . . . 0.0 113.336 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.9 mt -120.55 166.47 13.58 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 122.979 1.371 . . . . 0.0 114.635 -170.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.5 t -145.13 139.98 27.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 129.244 3.018 . . . . 0.0 106.892 169.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -117.43 146.6 21.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.163 0.985 . . . . 0.0 111.262 -169.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 -139.07 157.34 46.15 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.186 1.794 . . . . 0.0 109.88 175.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.24 170.54 18.73 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 172.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -160.31 161.8 24.86 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 127.819 2.447 . . . . 0.0 109.972 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.86 -15.89 5.48 Favored 'Cis proline' 0 CA--C 1.54 0.775 0 CA-C-N 121.442 1.551 . . . . 0.0 115.65 -10.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -65.43 -176.06 0.3 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.054 1.342 . . . . 0.0 112.692 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.09 147.2 57.73 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.151 0.98 . . . . 0.0 113.071 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -76.13 90.74 1.15 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.941 3.094 . . . . 0.0 110.891 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -155.42 162.31 40.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.222 1.409 . . . . 0.0 111.478 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -74.19 54.42 0.55 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.816 2.047 . . . . 0.0 114.076 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.2 m -58.65 157.01 9.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.308 1.443 . . . . 0.0 113.509 177.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -75.17 2.16 11.55 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -149.61 163.35 25.25 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 127.201 2.2 . . . . 0.0 109.652 179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -65.66 143.13 73.44 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 121.268 1.312 . . . . 0.0 109.564 168.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -73.97 -47.39 37.7 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.704 -0.622 . . . . 0.0 111.287 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.9 t -83.29 135.17 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.254 1.022 . . . . 0.0 109.314 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 93.8 t -134.98 144.73 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 123.777 0.831 . . . . 0.0 111.15 -178.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.0 mp -128.01 118.89 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 128.034 2.534 . . . . 0.0 109.411 -169.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.6 mt -78.61 161.51 26.92 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.081 0.943 . . . . 0.0 111.692 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.48 -27.39 66.08 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.005 1.322 . . . . 0.0 113.976 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -85.85 -8.14 58.27 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.091 1.756 . . . . 0.0 113.528 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 94.31 7.45 60.68 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.261 0.934 . . . . 0.0 114.669 -176.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -74.19 138.54 43.83 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.546 1.173 . . . . 0.0 108.502 169.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 5.1 mm -129.2 150.54 34.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.008 1.323 . . . . 0.0 109.235 -171.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.0 p -49.22 120.71 10.26 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 124.336 1.054 . . . . 0.0 111.778 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.16 84.44 1.51 Allowed 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.445 2.763 . . . . 0.0 111.71 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -122.01 -179.52 4.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.218 1.807 . . . . 0.0 111.878 -178.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.4 m -142.29 144.51 33.3 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.142 -0.974 . . . . 0.0 112.165 169.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.87 144.84 48.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 128.815 2.846 . . . . 0.0 108.78 -175.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.8 tt -135.6 146.75 48.25 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.373 1.469 . . . . 0.0 110.688 -178.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 56.3 mtt -123.55 131.58 53.67 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.074 1.35 . . . . 0.0 110.005 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -126.79 145.3 50.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.23 1.812 . . . . 0.0 110.932 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -52.99 129.75 31.57 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.531 1.132 . . . . 0.0 110.302 172.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.4 -18.32 17.17 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.377 1.992 . . . . 0.0 116.377 -174.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -126.4 -37.89 0.47 Allowed Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.749 -1.028 . . . . 0.0 115.222 -173.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 48.5 p -77.72 -26.05 49.77 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.793 1.796 . . . . 0.0 112.523 171.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 75.24 5.19 75.98 Favored Glycine 0 CA--C 1.537 1.468 0 C-N-CA 124.78 1.181 . . . . 0.0 114.104 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -72.66 124.34 90.65 Favored Pre-proline 0 CA--C 1.548 0.895 0 C-N-CA 125.002 1.321 . . . . 0.0 111.451 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.31 142.96 78.17 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.328 2.685 . . . . 0.0 113.292 170.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.69 -35.05 4.04 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.088 0.955 . . . . 0.0 111.555 172.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 10.8 tp -151.47 153.78 35.29 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.539 1.136 . . . . 0.0 111.055 -169.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.9 m -142.79 144.72 32.7 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 125.739 1.615 . . . . 0.0 108.814 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.3 mp -124.01 137.57 54.58 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.599 1.96 . . . . 0.0 108.759 179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.2 t -134.49 138.39 49.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.124 0.97 . . . . 0.0 111.113 -169.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.8 t -116.18 117.61 30.53 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.494 1.118 . . . . 0.0 111.552 -177.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 18.0 m -76.31 -8.13 56.45 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 122.19 0.94 10.46 Favored Glycine 0 CA--C 1.539 1.541 0 C-N-CA 125.481 1.515 . . . . 0.0 114.376 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 82.5 p -156.92 159.39 38.06 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.174 -1.192 . . . . 0.0 113.412 -173.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -62.51 138.43 96.54 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.997 1.719 . . . . 0.0 115.074 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -94.84 174.55 13.49 Favored 'Cis proline' 0 CA--C 1.546 1.097 0 CA-C-N 119.947 1.017 . . . . 0.0 110.812 -11.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.2 mp -67.96 153.75 43.06 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 122.269 1.033 . . . . 0.0 110.889 169.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -100.99 116.1 32.04 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.694 1.598 . . . . 0.0 110.752 -177.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.22 145.42 37.6 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.401 1.081 . . . . 0.0 111.291 176.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 14.8 t -147.47 148.3 31.1 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.957 1.703 . . . . 0.0 110.588 169.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -72.19 132.59 44.33 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.46 -0.775 . . . . 0.0 109.434 170.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 26.01 66.02 0.06 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.294 2.237 . . . . 0.0 115.836 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 32.7 mtm105 56.34 21.89 5.84 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.31 -27.39 67.28 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.978 1.717 . . . . 0.0 114.791 -177.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 69.4 p -101.52 7.2 42.46 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.817 1.247 . . . . 0.0 113.792 169.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 19.1 tpt85 -136.59 45.19 1.16 Allowed Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 126.362 1.865 . . . . 0.0 112.971 -173.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo . . . . . 0 C--O 1.251 1.155 0 C-N-CA 124.031 3.154 . . . . 0.0 114.068 -173.505 . . . . . . . . 0 0 . 1 stop_ save_