data_6d93_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6d93 _Structure_validation_residue.Date_analyzed 2019-04-26 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 ' 3' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -81.58 55.53 2.69 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.515 1.926 . . . . 0.0 110.779 176.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -42.25 -43.57 3.48 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.157 2.183 . . . . 0.0 115.206 -169.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -66.51 -39.47 88.68 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 121.637 2.017 . . . . 0.0 113.869 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -59.09 -38.62 79.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.485 1.514 . . . . 0.0 111.395 170.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 57.9 m -67.24 -48.54 67.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.307 0.643 . . . . 0.0 112.447 172.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.53 -39.22 90.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.129 0.972 . . . . 0.0 112.382 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -74.26 -33.74 63.38 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.936 0.789 . . . . 0.0 112.241 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -63.23 -39.48 94.73 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.405 -0.809 . . . . 0.0 111.39 171.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -70.54 -41.56 72.36 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.768 -0.582 . . . . 0.0 111.792 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -57.0 -41.47 78.53 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.393 0.997 . . . . 0.0 111.022 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.1 m -62.25 -27.41 68.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.331 1.052 . . . . 0.0 113.775 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 tp -86.22 -43.82 12.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.653 1.981 . . . . 0.0 110.422 173.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 150.4 4.67 0.21 Allowed Glycine 0 CA--C 1.534 1.243 0 CA-C-O 117.187 -1.896 . . . . 0.0 117.243 169.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -144.37 177.84 8.35 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.925 2.362 . . . . 0.0 114.516 -168.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.32 159.09 32.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.168 0.987 . . . . 0.0 112.713 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.7 155.5 16.27 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.491 1.044 . . . . 0.0 113.579 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -145.61 150.69 36.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.907 1.683 . . . . 0.0 111.818 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.5 m -77.97 154.15 31.82 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.717 -0.615 . . . . 0.0 111.034 168.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.1 mm -113.33 -37.91 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.982 1.713 . . . . 0.0 110.171 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.77 -111.27 0.39 Allowed Glycine 0 N--CA 1.463 0.47 0 N-CA-C 108.686 -1.765 . . . . 0.0 108.686 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.74 2.73 9.34 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.956 0.902 . . . . 0.0 113.364 168.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -136.52 158.74 43.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.352 2.261 . . . . 0.0 110.425 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.1 p -130.19 152.27 49.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.448 1.499 . . . . 0.0 112.276 173.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -137.91 167.77 21.08 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.53 1.532 . . . . 0.0 112.53 -174.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -109.22 148.76 30.43 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.9 m -144.4 152.64 54.11 Favored Pre-proline 0 N--CA 1.48 1.038 0 C-N-CA 125.636 1.574 . . . . 0.0 113.018 -172.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -61.48 158.7 35.05 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.899 3.066 . . . . 0.0 116.153 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.472 0 C-N-CA 127.163 2.185 . . . . 0.0 115.14 176.838 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 118.543 2.794 . . . . 0.0 118.543 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 57.11 32.64 22.03 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-N 119.759 1.163 . . . . 0.0 111.748 -166.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.62 -37.27 79.62 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.926 1.69 . . . . 0.0 112.768 -173.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -43.24 78.75 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.514 1.052 . . . . 0.0 110.013 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 54.5 mtt85 -69.89 -36.74 75.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.57 1.548 . . . . 0.0 112.449 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.2 t -65.43 -53.02 49.0 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.533 0.683 . . . . 0.0 111.128 173.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -23.63 59.32 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.031 -1.043 . . . . 0.0 113.365 -172.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.1 tp -59.04 -46.97 86.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.965 1.706 . . . . 0.0 110.905 168.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 t -61.3 -34.24 74.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.684 0.793 . . . . 0.0 111.751 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.98 -41.91 58.6 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.79 1.236 . . . . 0.0 112.657 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -63.79 -31.04 72.09 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.198 1.399 . . . . 0.0 112.158 175.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.0 m -62.81 -4.68 2.24 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.775 1.23 . . . . 0.0 113.647 167.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -122.38 -4.1 8.88 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.175 2.19 . . . . 0.0 112.854 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.43 -6.43 71.33 Favored Glycine 0 CA--C 1.542 1.746 0 C-N-CA 126.777 2.132 . . . . 0.0 116.242 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.83 157.1 35.58 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.912 2.085 . . . . 0.0 112.922 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.1 mt -110.81 151.82 27.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.507 1.523 . . . . 0.0 109.623 169.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.33 157.06 17.0 Favored Glycine 0 N--CA 1.476 1.327 0 CA-C-N 119.349 0.977 . . . . 0.0 114.508 -178.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -146.74 144.74 29.62 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.855 1.662 . . . . 0.0 112.374 173.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.76 122.95 26.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.103 0.561 . . . . 0.0 110.879 171.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.9 mm -81.16 -22.6 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.586 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.48 -68.16 0.5 Allowed Glycine 0 CA--C 1.524 0.651 0 C-N-CA 126.637 2.065 . . . . 0.0 110.685 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -87.58 -19.42 27.84 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.052 1.741 . . . . 0.0 113.083 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -137.17 162.2 34.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.558 1.943 . . . . 0.0 111.425 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.12 151.24 21.19 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.033 1.333 . . . . 0.0 110.046 168.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -138.63 146.86 42.21 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.333 1.053 . . . . 0.0 110.706 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -115.38 154.97 28.24 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.51 1.124 . . . . 0.0 113.221 173.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.6 m -143.46 155.88 60.59 Favored Pre-proline 0 N--CA 1.471 0.603 0 C-N-CA 126.654 1.982 . . . . 0.0 110.775 -173.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -66.09 156.63 63.73 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.551 2.167 . . . . 0.0 113.289 173.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.218 0 C-N-CA 125.218 1.407 . . . . 0.0 113.199 179.774 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.7 p . . . . . 0 CA--C 1.549 0.942 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.255 4.5 m-80 57.94 23.65 10.1 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.479 2.312 . . . . 0.0 115.907 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -50.93 -37.02 41.63 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.287 1.035 . . . . 0.0 112.708 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -58.22 -33.22 69.08 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -175.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -97.73 -30.24 12.92 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.476 1.035 . . . . 0.0 112.492 172.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -57.01 -48.08 79.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.103 0.961 . . . . 0.0 112.288 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -53.83 -42.11 68.12 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.309 1.044 . . . . 0.0 112.319 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.54 -44.68 70.46 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.248 2.219 . . . . 0.0 111.445 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 t -71.26 -34.7 70.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.783 1.233 . . . . 0.0 112.617 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 57.6 m -71.59 -27.44 63.13 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.487 -0.758 . . . . 0.0 111.608 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -56.64 -31.83 64.73 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.618 1.167 . . . . 0.0 112.212 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.8 t -62.28 -22.58 66.12 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.82 1.248 . . . . 0.0 113.878 174.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.2 mt -105.65 -7.35 18.54 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.934 1.694 . . . . 0.0 113.124 173.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.0 21.35 25.78 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.516 1.531 . . . . 0.0 116.171 173.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.9 167.21 22.52 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.008 1.404 . . . . 0.0 113.278 -177.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.6 mt -79.33 167.59 20.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.453 1.501 . . . . 0.0 112.178 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.51 137.29 14.14 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.859 1.218 . . . . 0.0 111.969 169.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -132.72 138.01 47.09 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.353 1.461 . . . . 0.0 110.735 176.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 89.5 m -70.49 124.88 25.28 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 171.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -110.51 78.68 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 127.37 2.268 . . . . 0.0 106.805 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.42 -124.38 7.18 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 125.932 1.73 . . . . 0.0 112.415 -172.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -74.57 3.18 8.13 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.498 2.319 . . . . 0.0 114.788 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -151.15 136.25 17.5 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.523 1.129 . . . . 0.0 111.674 -166.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -95.24 138.59 32.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.538 0.735 . . . . 0.0 112.711 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -132.19 156.28 46.72 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.494 2.318 . . . . 0.0 110.644 -177.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.4 m -82.67 137.28 34.51 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.591 -0.693 . . . . 0.0 112.399 -175.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 m -136.38 145.27 51.05 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 125.132 1.373 . . . . 0.0 112.776 -173.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.66 151.49 83.34 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.248 2.632 . . . . 0.0 113.752 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.134 1.374 . . . . 0.0 113.752 174.908 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.7 m . . . . . 0 CA--C 1.536 0.439 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -83.82 55.05 3.1 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.615 1.166 . . . . 0.0 108.879 170.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 19.3 tp -52.45 -33.1 42.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.703 1.601 . . . . 0.0 115.169 -168.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 66.1 ttp85 -62.73 -48.97 76.9 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.768 1.622 . . . . 0.0 112.571 173.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -65.87 -29.6 70.08 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.603 0.761 . . . . 0.0 112.198 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.5 m -68.84 -51.09 44.29 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.672 0.789 . . . . 0.0 110.88 169.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -60.06 -43.3 95.53 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.165 0.986 . . . . 0.0 112.301 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 pp -69.55 -34.66 74.51 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.003 0.82 . . . . 0.0 111.989 -178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -63.73 -47.35 81.42 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.873 0.869 . . . . 0.0 111.1 171.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.79 -37.23 62.43 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 118.118 0.417 . . . . 0.0 112.089 -176.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -61.33 -33.71 74.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.802 1.241 . . . . 0.0 111.738 173.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 m -67.65 -2.45 6.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 171.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.0 mt -124.08 9.96 8.73 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.268 2.227 . . . . 0.0 112.476 172.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.64 -4.86 62.95 Favored Glycine 0 CA--C 1.541 1.689 0 N-CA-C 116.159 1.224 . . . . 0.0 116.159 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.16 171.12 11.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.347 2.259 . . . . 0.0 113.174 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -123.53 137.05 54.85 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.338 1.855 . . . . 0.0 108.738 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.13 136.31 13.47 Favored Glycine 0 N--CA 1.468 0.82 0 C-N-CA 125.534 1.54 . . . . 0.0 114.583 -176.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -134.42 140.93 46.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.493 1.917 . . . . 0.0 110.881 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.5 t -76.37 140.17 41.29 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.195 -0.941 . . . . 0.0 111.728 169.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.8 mt -85.02 -58.27 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.127 0.971 . . . . 0.0 109.729 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -168.09 -49.37 0.03 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.863 1.697 . . . . 0.0 112.073 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.82 -11.94 6.57 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.623 1.569 . . . . 0.0 113.753 170.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -115.63 149.38 38.4 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.853 1.661 . . . . 0.0 113.181 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.1 m -83.93 147.9 27.23 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.416 1.086 . . . . 0.0 111.951 167.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -131.4 130.09 42.14 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.587 1.955 . . . . 0.0 109.245 170.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.6 m -119.71 136.99 54.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.272 0.629 . . . . 0.0 112.359 177.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -137.95 161.99 56.66 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.846 1.658 . . . . 0.0 110.379 -173.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.83 156.75 41.65 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.388 2.059 . . . . 0.0 113.052 172.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.32 175.329 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -78.49 40.42 0.37 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.338 1.455 . . . . 0.0 111.211 169.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 15.3 tp -57.15 -31.61 65.54 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.117 1.367 . . . . 0.0 114.331 -167.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -58.85 -35.44 72.93 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.466 1.106 . . . . 0.0 113.124 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -81.79 -35.93 28.98 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.14 1.376 . . . . 0.0 111.642 173.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -61.86 -45.78 92.32 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.164 0.586 . . . . 0.0 112.063 178.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -56.57 -45.91 81.04 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.853 -0.529 . . . . 0.0 111.856 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -70.08 -39.25 75.71 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.868 2.067 . . . . 0.0 111.591 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.3 m -60.44 -46.19 90.95 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.247 1.019 . . . . 0.0 110.868 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.5 m -78.0 -29.66 49.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.527 0.731 . . . . 0.0 112.216 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.66 -38.26 89.63 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 120.375 -1.453 . . . . 0.0 111.255 170.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.5 m -70.01 -14.07 62.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.771 1.229 . . . . 0.0 114.103 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -103.26 -14.95 16.13 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.082 1.353 . . . . 0.0 113.159 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.18 37.28 6.32 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.471 1.51 . . . . 0.0 115.286 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -150.94 163.6 38.31 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 118.976 1.388 . . . . 0.0 113.301 175.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.0 mp -90.6 158.43 16.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.269 1.828 . . . . 0.0 111.883 -172.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.87 154.25 16.47 Favored Glycine 0 N--CA 1.478 1.49 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -151.16 140.22 21.11 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.129 1.772 . . . . 0.0 113.244 173.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.8 t -75.51 138.84 41.82 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 120.787 -1.196 . . . . 0.0 111.992 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.3 mt -142.25 103.33 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 122.33 1.062 . . . . 0.0 112.074 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 -60.16 2.84 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 127.942 2.687 . . . . 0.0 114.582 168.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.26 5.6 0.64 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -159.7 154.62 24.68 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.073 0.851 . . . . 0.0 110.968 -178.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.98 146.64 27.89 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.292 -0.88 . . . . 0.0 112.695 177.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -128.63 158.41 38.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.7 1.6 . . . . 0.0 109.86 171.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 88.2 m -119.16 153.71 34.45 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.734 0.778 . . . . 0.0 112.63 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 m -140.73 151.48 63.23 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 126.287 1.835 . . . . 0.0 111.837 -168.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -65.44 155.98 65.89 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.902 2.401 . . . . 0.0 116.648 -168.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.385 0 C-N-CA 126.824 2.05 . . . . 0.0 114.298 174.919 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.9 t . . . . . 0 CA--C 1.537 0.475 0 CA-C-O 121.38 0.609 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -71.58 34.75 0.06 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.302 1.841 . . . . 0.0 112.524 169.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -49.16 -46.7 45.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.686 1.994 . . . . 0.0 113.737 -167.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -67.9 -37.38 81.65 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -64.25 -42.57 96.45 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.312 1.445 . . . . 0.0 110.988 169.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.0 m -66.03 -43.14 88.49 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.221 0.608 . . . . 0.0 111.888 179.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -62.78 -35.41 79.75 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.884 -1.135 . . . . 0.0 112.58 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 tp -69.67 -37.54 76.73 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.791 1.636 . . . . 0.0 111.027 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.4 t -65.25 -44.51 87.9 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.074 -1.016 . . . . 0.0 111.33 173.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.9 m -70.65 -26.59 63.53 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.143 -0.973 . . . . 0.0 112.222 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -60.63 -24.71 65.75 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.043 -1.036 . . . . 0.0 112.396 170.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.3 p -63.38 -38.9 92.92 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.466 1.03 . . . . 0.0 112.848 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.4 mt -98.39 12.5 34.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.377 1.471 . . . . 0.0 113.045 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.49 22.11 56.99 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.725 1.45 . . . . 0.0 116.725 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.11 -174.56 3.58 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.211 1.506 . . . . 0.0 113.844 -175.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -97.76 156.45 16.56 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.673 1.589 . . . . 0.0 111.905 -174.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.04 150.67 17.14 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 124.723 1.154 . . . . 0.0 114.329 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -137.93 149.47 46.21 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.016 2.126 . . . . 0.0 112.159 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.2 m -91.05 145.5 24.64 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.789 1.236 . . . . 0.0 112.632 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.7 mm -139.83 74.78 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.573 1.549 . . . . 0.0 108.715 169.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.02 -120.06 8.39 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.225 1.393 . . . . 0.0 112.974 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -75.09 -5.53 44.71 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.474 -1.015 . . . . 0.0 113.425 172.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -120.13 177.9 4.83 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.894 1.678 . . . . 0.0 111.717 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 30.1 m -136.09 162.47 32.81 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 125.073 1.349 . . . . 0.0 112.591 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -136.01 175.73 9.33 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.357 2.263 . . . . 0.0 110.767 171.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.4 m -116.14 164.38 14.56 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.581 0.752 . . . . 0.0 110.59 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -142.12 149.21 51.37 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.947 1.699 . . . . 0.0 110.348 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.1 139.58 85.54 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.688 2.259 . . . . 0.0 112.018 177.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.293 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -176.643 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.2 t . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -81.02 54.3 2.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.574 1.549 . . . . 0.0 110.985 168.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.4 tt -47.83 -39.22 17.79 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.939 2.096 . . . . 0.0 112.891 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -59.81 -40.27 87.82 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.705 1.202 . . . . 0.0 113.573 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -71.0 -36.39 72.45 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.078 1.751 . . . . 0.0 111.657 172.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.4 m -66.33 -43.28 86.6 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.191 0.905 . . . . 0.0 112.8 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -62.26 -38.47 89.4 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.035 -1.04 . . . . 0.0 112.547 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.5 -42.51 87.27 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.02 1.728 . . . . 0.0 110.347 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -59.84 -47.91 83.84 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.361 1.065 . . . . 0.0 111.592 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.0 m -74.04 -21.16 60.06 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.958 -1.089 . . . . 0.0 112.931 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -61.76 -22.05 65.07 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.921 -1.112 . . . . 0.0 112.549 169.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 p -74.55 -28.4 60.93 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 170.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.2 mt -90.84 -15.72 29.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.675 1.99 . . . . 0.0 113.319 177.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.13 18.11 11.77 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.527 1.537 . . . . 0.0 116.053 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -155.12 -178.12 7.02 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 119.743 1.772 . . . . 0.0 113.26 -173.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.58 167.19 21.63 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.219 1.408 . . . . 0.0 111.264 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.98 146.04 16.5 Favored Glycine 0 N--CA 1.473 1.145 0 O-C-N 121.029 -1.044 . . . . 0.0 114.915 -174.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -147.24 152.6 38.59 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.962 2.105 . . . . 0.0 110.393 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.8 m -77.74 131.8 37.83 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.123 -0.986 . . . . 0.0 112.301 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.8 mm -130.18 87.1 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-O 122.866 1.317 . . . . 0.0 108.674 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.13 -143.79 31.26 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 113.85 -1.523 . . . . 0.0 112.383 -170.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -74.83 21.74 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -155.83 149.36 24.92 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.665 -1.272 . . . . 0.0 112.304 -175.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.7 m -79.95 135.26 36.36 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 113.297 175.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -117.77 158.96 23.83 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.655 1.982 . . . . 0.0 110.032 167.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.4 m -113.87 149.03 35.68 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -169.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.8 m -135.11 153.06 78.1 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 125.794 1.637 . . . . 0.0 112.041 -170.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -67.77 151.11 79.08 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.813 2.342 . . . . 0.0 115.683 -169.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.607 1.563 . . . . 0.0 113.882 171.501 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.3 t . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -81.28 49.76 1.33 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.549 1.939 . . . . 0.0 112.036 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.4 tp -61.81 -40.77 96.41 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -172.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -66.48 -33.43 75.67 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.1 1.318 . . . . 0.0 112.061 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -73.64 -38.64 64.95 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.908 0.883 . . . . 0.0 112.224 168.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -59.17 -42.22 90.29 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.024 0.829 . . . . 0.0 111.563 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.38 -47.52 78.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.168 0.987 . . . . 0.0 112.632 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.3 tp -73.06 -29.99 63.37 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.862 1.665 . . . . 0.0 112.119 -177.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.0 t -63.94 -36.87 85.37 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.433 1.093 . . . . 0.0 111.649 169.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.47 -30.93 33.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.273 -0.892 . . . . 0.0 113.008 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -52.26 -36.63 53.15 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.003 0.921 . . . . 0.0 111.57 169.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 p -57.44 -28.63 63.5 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.4 mt -104.38 5.47 34.4 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.56 1.944 . . . . 0.0 113.698 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.14 12.42 67.98 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.57 178.24 7.15 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.594 1.697 . . . . 0.0 112.608 -177.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.0 mt -83.03 160.33 21.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.588 1.155 . . . . 0.0 111.906 -176.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.9 153.0 17.57 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 123.83 0.729 . . . . 0.0 112.672 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -149.88 132.07 15.44 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.87 0.868 . . . . 0.0 111.679 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.5 t -86.18 124.77 32.95 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.79 0.436 . . . . 0.0 110.611 169.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.19 33.82 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.811 1.644 . . . . 0.0 110.553 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.34 -64.5 1.36 Allowed Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.769 1.652 . . . . 0.0 113.317 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -74.83 -33.87 62.23 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.276 1.43 . . . . 0.0 113.504 -176.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -158.79 155.3 27.66 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.466 1.106 . . . . 0.0 112.593 -168.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -83.69 143.93 29.72 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.604 1.162 . . . . 0.0 111.355 169.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -151.09 161.08 43.4 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.185 1.394 . . . . 0.0 111.959 167.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 m -94.7 150.42 20.24 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -141.97 148.48 48.98 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 125.774 1.63 . . . . 0.0 111.136 -173.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -65.61 138.07 52.79 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.203 2.602 . . . . 0.0 113.965 -172.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.073 1.749 . . . . 0.0 113.746 179.561 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.7 p . . . . . 0 CA--C 1.543 0.704 0 CA-C-O 122.278 1.037 . . . . 0.0 113.485 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -79.1 49.85 0.99 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 128.312 2.645 . . . . 0.0 111.612 177.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -47.48 -37.82 12.58 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.972 1.309 . . . . 0.0 113.445 -170.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -57.46 -45.06 85.19 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.175 0.99 . . . . 0.0 113.63 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.13 -37.26 66.72 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.173 1.789 . . . . 0.0 110.889 173.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 64.2 m -60.48 -43.37 97.05 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.413 0.685 . . . . 0.0 112.826 175.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -56.27 -47.04 79.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.534 1.061 . . . . 0.0 110.947 172.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tp -63.21 -39.53 94.88 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.566 1.546 . . . . 0.0 111.503 177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 m -63.06 -37.82 88.73 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.503 1.521 . . . . 0.0 113.186 171.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 64.5 m -78.08 -34.92 49.98 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.627 -0.671 . . . . 0.0 111.904 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -30.53 71.36 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.857 -1.152 . . . . 0.0 111.762 176.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.7 t -63.24 -41.64 99.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 0.0 111.676 168.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.15 -6.41 54.69 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.151 1.38 . . . . 0.0 113.662 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.54 13.15 56.09 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 125.981 1.753 . . . . 0.0 115.79 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -141.63 171.86 13.48 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.898 1.349 . . . . 0.0 113.404 -175.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.4 mt -75.07 151.09 38.69 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 112.289 -173.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.34 136.88 12.94 Favored Glycine 0 N--CA 1.471 0.98 0 O-C-N 121.409 -0.807 . . . . 0.0 112.864 173.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -143.55 166.93 23.46 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.848 1.659 . . . . 0.0 110.874 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 t -150.07 153.43 36.42 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -173.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -129.48 103.07 8.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 126.349 1.859 . . . . 0.0 107.53 167.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.03 -102.3 0.34 Allowed Glycine 0 CA--C 1.534 1.278 0 C-N-CA 127.087 2.28 . . . . 0.0 114.533 176.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.03 10.48 28.88 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.816 2.047 . . . . 0.0 113.034 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -143.15 115.6 8.55 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.138 -1.601 . . . . 0.0 113.677 -173.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.2 m -84.6 138.91 32.45 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.66 1.584 . . . . 0.0 112.311 169.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.17 135.88 26.0 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.354 1.462 . . . . 0.0 110.495 169.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 m -78.32 153.43 31.73 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.9 m -141.82 148.95 51.43 Favored Pre-proline 0 N--CA 1.478 0.942 0 C-N-CA 124.856 1.263 . . . . 0.0 112.054 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_exo -67.67 161.74 42.38 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.658 2.239 . . . . 0.0 112.961 170.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.258 1.533 0 C-N-CA 124.748 1.219 . . . . 0.0 112.765 174.179 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.8 p . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.9 m120 51.73 32.92 10.12 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 127.511 2.324 . . . . 0.0 114.897 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.7 -31.0 24.3 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 -168.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -59.02 -40.19 84.24 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.12 1.327 . . . . 0.0 112.245 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 mmm180 -70.34 -39.78 74.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.469 1.107 . . . . 0.0 111.569 174.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.3 m -67.62 -43.7 79.77 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.269 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.42 -34.72 78.85 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.196 -0.94 . . . . 0.0 113.194 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tp -66.93 -36.69 82.8 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 110.393 171.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.9 m -66.88 -42.44 85.56 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.463 -0.773 . . . . 0.0 111.397 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.96 -36.86 75.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.879 0.763 . . . . 0.0 111.669 175.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -54.65 -40.71 69.28 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.995 -1.065 . . . . 0.0 111.163 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.1 m -75.01 3.27 8.66 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.885 1.674 . . . . 0.0 114.693 176.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -123.9 2.47 8.74 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.008 2.123 . . . . 0.0 112.271 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.35 19.53 66.41 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 125.387 1.47 . . . . 0.0 115.884 177.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -139.9 173.32 11.64 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.81 1.805 . . . . 0.0 112.747 -177.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.6 mt -86.58 176.74 7.65 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.164 1.386 . . . . 0.0 111.553 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -154.46 153.92 25.15 Favored Glycine 0 N--CA 1.474 1.171 0 O-C-N 120.902 -1.124 . . . . 0.0 115.128 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -141.32 147.43 38.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.446 1.498 . . . . 0.0 112.226 -174.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.1 t -81.64 133.85 35.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.747 0.819 . . . . 0.0 112.178 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.0 mt -122.32 65.08 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 127.075 2.15 . . . . 0.0 108.877 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.95 -69.73 0.78 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 127.209 2.337 . . . . 0.0 115.016 176.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -100.74 -18.03 16.67 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.031 1.332 . . . . 0.0 112.954 -174.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -146.52 176.32 9.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 126.371 1.868 . . . . 0.0 112.143 -169.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 29.6 p -126.82 142.68 51.48 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.896 1.278 . . . . 0.0 111.396 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -135.6 150.73 49.76 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.151 0.98 . . . . 0.0 111.853 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 m -79.55 155.03 28.38 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 169.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -143.51 151.0 53.1 Favored Pre-proline 0 N--CA 1.476 0.852 0 C-N-CA 126.206 1.803 . . . . 0.0 111.039 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -59.2 146.7 93.68 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.192 2.595 . . . . 0.0 114.954 -173.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.966 1.706 . . . . 0.0 112.487 173.41 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.42 45.53 0.67 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.54 1.536 . . . . 0.0 111.14 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.48 -38.49 44.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.463 2.305 . . . . 0.0 113.063 -168.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -64.31 -35.35 80.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.313 -0.867 . . . . 0.0 112.773 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -85.56 -32.15 22.29 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.359 1.464 . . . . 0.0 113.545 171.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -68.46 -35.46 77.59 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.089 0.859 . . . . 0.0 112.354 176.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.23 -36.47 66.05 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.194 -1.566 . . . . 0.0 111.954 169.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.4 tp -82.05 -37.78 25.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.06 1.744 . . . . 0.0 111.37 -177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 83.6 p -65.0 -41.81 95.06 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.474 1.033 . . . . 0.0 111.179 175.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.25 -41.92 84.81 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.008 -0.432 . . . . 0.0 110.425 174.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -61.86 -33.35 74.03 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.811 -1.181 . . . . 0.0 112.402 176.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 41.7 t -66.4 -29.35 69.48 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.064 0.946 . . . . 0.0 112.658 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.79 -48.04 17.51 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.92 -1.112 . . . . 0.0 111.126 170.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 144.65 15.71 0.22 Allowed Glycine 0 CA--C 1.537 1.453 0 CA-C-O 117.82 -1.544 . . . . 0.0 116.098 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.94 179.53 7.41 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 120.202 2.001 . . . . 0.0 113.132 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.3 mt -88.46 160.05 17.7 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.851 -1.155 . . . . 0.0 112.844 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.26 138.7 15.14 Favored Glycine 0 N--CA 1.469 0.881 0 C-N-CA 124.295 0.95 . . . . 0.0 113.801 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -141.7 171.25 14.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.354 2.261 . . . . 0.0 109.826 172.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.0 t -150.06 139.01 20.99 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 -174.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.8 mm -117.91 115.41 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.468 1.907 . . . . 0.0 110.57 -174.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -87.03 0.18 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 126.139 1.828 . . . . 0.0 111.676 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 50.0 mp0 -129.42 5.23 5.18 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.17 1.788 . . . . 0.0 112.71 172.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -115.77 117.17 29.49 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.169 0.988 . . . . 0.0 113.163 -168.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.0 m -74.36 138.98 43.78 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 120.569 -1.332 . . . . 0.0 113.153 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -147.13 127.22 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.793 1.637 . . . . 0.0 111.285 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.8 m -77.65 147.69 35.42 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -130.18 148.29 69.15 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 126.532 1.933 . . . . 0.0 110.64 -175.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -65.26 145.29 83.51 Favored 'Trans proline' 0 C--O 1.239 0.547 0 C-N-CA 122.44 2.094 . . . . 0.0 112.901 -171.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 C-N-CA 125.493 1.517 . . . . 0.0 111.158 177.138 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.5 t . . . . . 0 CA--C 1.552 1.035 0 CA-C-O 121.065 0.46 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -111.65 66.5 0.63 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.196 1.798 . . . . 0.0 111.401 -168.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.56 -42.08 15.32 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.207 1.803 . . . . 0.0 114.073 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -65.43 -34.04 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 120.24 -1.538 . . . . 0.0 113.519 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -73.1 -38.14 66.48 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.955 0.902 . . . . 0.0 111.29 172.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.7 t -62.65 -40.84 98.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.473 1.109 . . . . 0.0 112.098 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -58.25 -41.54 84.46 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.864 1.265 . . . . 0.0 112.446 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.2 tp -69.71 -42.71 73.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.377 0.989 . . . . 0.0 110.125 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.9 t -57.82 -39.02 76.62 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.788 -0.57 . . . . 0.0 112.485 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.4 m -79.67 -32.92 41.55 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.474 -0.766 . . . . 0.0 112.975 175.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -60.49 -29.65 69.21 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.644 -1.285 . . . . 0.0 112.539 170.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.6 p -67.64 -14.47 62.97 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 172.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -103.24 -24.71 13.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.151 1.78 . . . . 0.0 112.502 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.01 2.14 28.38 Favored Glycine 0 CA--C 1.542 1.759 0 C-N-CA 125.905 1.717 . . . . 0.0 116.076 174.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -121.24 171.96 8.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.983 1.713 . . . . 0.0 112.347 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -73.74 154.31 39.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.952 1.301 . . . . 0.0 112.117 -173.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.95 141.89 15.61 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 123.933 0.778 . . . . 0.0 113.938 175.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -138.2 153.39 49.16 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.602 1.561 . . . . 0.0 111.729 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 m -100.19 95.28 6.71 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.247 1.419 . . . . 0.0 110.183 172.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -82.86 68.65 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-O 123.204 1.478 . . . . 0.0 110.146 -176.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.84 -92.33 0.19 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 127.083 2.278 . . . . 0.0 111.879 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -66.78 -28.61 68.53 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 -177.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -155.96 168.06 28.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.75 1.613 . . . . 0.0 114.739 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 t -70.92 132.8 45.77 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.932 0.893 . . . . 0.0 112.712 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -140.07 139.24 35.86 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.15 1.38 . . . . 0.0 110.12 168.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.6 m -87.19 152.69 22.1 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.825 -0.547 . . . . 0.0 112.24 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -138.79 151.8 69.25 Favored Pre-proline 0 N--CA 1.48 1.03 0 C-N-CA 125.088 1.355 . . . . 0.0 111.848 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -65.23 130.5 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 122.713 2.275 . . . . 0.0 111.293 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.404 0 C-N-CA 124.807 1.243 . . . . 0.0 113.417 -174.635 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.3 p . . . . . 0 CA--C 1.551 0.982 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -84.93 44.2 1.05 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.543 1.937 . . . . 0.0 112.754 -176.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.97 -39.61 90.52 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.36 1.464 . . . . 0.0 113.062 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -44.51 68.91 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.244 1.418 . . . . 0.0 110.865 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -69.28 -38.06 78.18 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.978 1.711 . . . . 0.0 112.97 172.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.75 -41.43 97.66 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.502 0.592 . . . . 0.0 112.478 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -63.06 -34.74 78.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.22 -0.925 . . . . 0.0 112.288 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -45.29 65.49 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.738 2.415 . . . . 0.0 110.839 174.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.0 t -58.4 -48.95 79.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.568 1.147 . . . . 0.0 111.509 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -70.88 -31.94 68.75 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.381 -0.824 . . . . 0.0 111.871 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -60.89 -24.79 66.24 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.618 -1.301 . . . . 0.0 113.244 169.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 p -61.84 -28.91 69.82 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.279 1.399 . . . . 0.0 112.326 173.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.06 -2.5 27.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.222 2.209 . . . . 0.0 113.404 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.63 30.83 20.32 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 174.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.5 171.87 13.46 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 119.812 1.806 . . . . 0.0 113.73 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.3 mt -79.25 170.96 15.85 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.977 1.711 . . . . 0.0 112.291 -175.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.99 146.58 17.94 Favored Glycine 0 CA--C 1.537 1.411 0 N-CA-C 115.401 0.92 . . . . 0.0 115.401 -175.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -140.6 156.33 46.31 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.593 2.357 . . . . 0.0 111.508 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.1 p -110.05 55.4 0.64 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.108 1.363 . . . . 0.0 112.512 174.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.9 mm -55.49 -47.6 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.297 1.439 . . . . 0.0 113.446 -168.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -107.9 41.66 2.15 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.652 1.596 . . . . 0.0 112.257 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 64.21 -33.4 0.14 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 127.37 2.268 . . . . 0.0 114.837 -169.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -79.59 150.78 30.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.951 1.701 . . . . 0.0 112.096 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -65.16 131.68 47.17 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -176.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -129.14 128.5 43.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.255 2.222 . . . . 0.0 109.099 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 27.9 m -85.1 147.52 26.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 174.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.3 m -137.07 149.3 65.88 Favored Pre-proline 0 N--CA 1.479 1.011 0 C-N-CA 124.912 1.285 . . . . 0.0 112.107 -170.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.04 137.72 38.29 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 123.297 2.665 . . . . 0.0 114.404 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 C-N-CA 126.574 1.95 . . . . 0.0 113.114 -178.971 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.3 m . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.41 36.62 0.43 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.507 1.923 . . . . 0.0 112.492 174.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mt -55.87 -48.01 76.34 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.021 1.328 . . . . 0.0 113.453 -170.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.7 ttp85 -63.8 -34.81 78.74 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.656 -1.278 . . . . 0.0 111.341 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -72.08 -34.31 68.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 126.883 2.073 . . . . 0.0 113.906 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.91 -40.38 28.35 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.782 0.719 . . . . 0.0 112.127 175.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -53.39 -35.07 59.96 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.63 1.572 . . . . 0.0 112.974 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.32 -31.6 72.49 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.591 1.087 . . . . 0.0 112.994 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.0 t -77.6 -39.33 45.9 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.409 1.084 . . . . 0.0 111.07 171.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.9 m -66.3 -38.64 88.22 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.084 -1.01 . . . . 0.0 111.372 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -43.48 89.82 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.52 1.128 . . . . 0.0 111.196 170.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -59.3 -32.89 70.46 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.484 0.714 . . . . 0.0 112.872 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 97.0 mt -91.17 -4.8 55.8 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.006 1.722 . . . . 0.0 113.632 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 29.88 57.74 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.711 1.624 . . . . 0.0 115.907 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.31 178.43 7.42 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 118.42 1.11 . . . . 0.0 112.489 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -91.58 147.62 22.87 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.975 -1.078 . . . . 0.0 112.415 -169.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -88.77 137.39 14.22 Favored Glycine 0 CA--C 1.533 1.167 0 O-C-N 121.462 -0.773 . . . . 0.0 112.368 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -145.26 137.02 25.47 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.701 1.2 . . . . 0.0 111.023 176.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -81.67 73.68 8.7 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.415 -0.803 . . . . 0.0 110.901 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 pt -64.12 -17.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -170.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.17 115.84 0.34 Allowed Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.458 1.028 . . . . 0.0 111.908 169.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 61.99 -35.74 0.11 Allowed 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 128.951 2.9 . . . . 0.0 115.889 -172.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -139.17 158.01 44.93 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 127.556 2.342 . . . . 0.0 110.644 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -87.21 140.79 29.19 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.033 1.123 . . . . 0.0 114.033 -178.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -134.44 156.67 48.15 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.996 1.719 . . . . 0.0 108.982 168.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 5.6 m -85.05 144.71 28.08 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.054 -0.404 . . . . 0.0 111.436 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.7 m -135.93 148.19 64.02 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 125.81 1.644 . . . . 0.0 111.016 -173.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.16 151.67 72.48 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.661 2.241 . . . . 0.0 111.382 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.337 0 C-N-CA 125.19 1.396 . . . . 0.0 112.073 174.989 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.3 t . . . . . 0 CA--C 1.549 0.923 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 m120 56.65 47.51 18.24 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.415 2.286 . . . . 0.0 111.654 -169.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.0 tt -53.86 -34.64 59.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.461 1.504 . . . . 0.0 113.193 -174.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.8 ttp180 -69.06 -32.85 72.61 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.762 0.825 . . . . 0.0 112.287 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -69.64 -43.69 72.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.655 1.182 . . . . 0.0 110.432 170.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -58.34 -49.26 77.85 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.864 176.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.11 -41.92 84.62 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.889 0.876 . . . . 0.0 113.191 174.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.72 -39.88 95.39 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.953 1.301 . . . . 0.0 110.802 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 p -59.88 -36.73 77.55 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.605 -0.684 . . . . 0.0 112.253 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.4 m -85.6 -37.01 20.01 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.99 0.916 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -56.8 -39.61 74.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.883 1.673 . . . . 0.0 112.067 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 m -62.36 -23.15 66.64 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.186 0.994 . . . . 0.0 113.108 175.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.7 mt -103.79 7.05 37.08 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 127.649 2.38 . . . . 0.0 113.714 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.5 23.07 61.14 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 125.099 1.333 . . . . 0.0 116.287 174.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.84 176.76 9.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.749 1.775 . . . . 0.0 113.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.8 mt -91.23 151.98 20.7 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.802 0.841 . . . . 0.0 112.537 -169.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.96 142.82 16.19 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.285 0.945 . . . . 0.0 114.314 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -134.57 114.36 12.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.324 1.45 . . . . 0.0 109.321 177.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -105.88 117.43 34.02 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.229 1.012 . . . . 0.0 110.719 -171.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -83.06 -45.7 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 124.354 1.061 . . . . 0.0 111.142 -170.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.57 107.0 0.79 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 126.442 1.973 . . . . 0.0 109.078 -169.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 60.68 4.99 0.83 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.055 1.742 . . . . 0.0 115.606 -167.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -149.8 147.32 27.86 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.446 1.498 . . . . 0.0 112.351 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.5 t -127.27 143.76 51.18 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.387 1.875 . . . . 0.0 110.833 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -136.07 159.11 42.73 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.674 1.99 . . . . 0.0 109.739 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 m -101.31 152.4 20.74 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.1 m -133.55 144.95 54.32 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.661 1.585 . . . . 0.0 111.969 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -62.17 150.39 86.93 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.187 2.592 . . . . 0.0 113.879 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.377 0 C-N-CA 125.072 1.349 . . . . 0.0 112.075 174.369 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.9 t . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -85.27 39.56 0.78 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 -173.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -49.49 -47.28 48.68 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.455 1.502 . . . . 0.0 114.776 -171.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -66.05 -37.09 84.96 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.107 1.322 . . . . 0.0 113.608 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -74.55 -37.93 62.87 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.44 1.096 . . . . 0.0 111.729 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.1 t -63.95 -44.88 91.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.528 1.131 . . . . 0.0 111.876 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -56.38 -35.59 67.9 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.207 1.003 . . . . 0.0 113.332 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.6 tp -71.2 -34.08 70.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 110.877 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -72.43 -41.22 66.43 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.792 -1.192 . . . . 0.0 112.192 172.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.6 m -68.45 -29.71 68.42 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.023 -1.048 . . . . 0.0 111.468 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.43 -37.16 74.81 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.203 1.001 . . . . 0.0 111.381 168.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.4 p -67.49 -17.85 64.84 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.7 mt -107.72 1.66 23.19 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.18 2.192 . . . . 0.0 112.783 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.43 28.37 69.79 Favored Glycine 0 CA--C 1.539 1.578 0 O-C-N 120.82 -1.175 . . . . 0.0 115.833 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -142.41 -178.27 5.67 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 119.109 1.454 . . . . 0.0 112.723 178.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 mt -88.79 148.77 23.75 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.64 1.176 . . . . 0.0 112.083 -173.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -92.34 141.11 15.44 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.187 -0.785 . . . . 0.0 111.984 168.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -148.77 129.95 14.56 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.373 1.069 . . . . 0.0 112.982 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.7 m -84.17 118.78 24.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 112.34 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.1 mm -147.69 125.0 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.938 1.695 . . . . 0.0 109.801 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.05 47.37 13.5 Favored Glycine 0 CA--C 1.534 1.25 0 O-C-N 121.646 -0.659 . . . . 0.0 113.872 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 65.74 6.64 4.02 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.27 2.228 . . . . 0.0 116.486 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -146.2 151.66 37.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.238 1.015 . . . . 0.0 113.012 173.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -79.85 142.19 35.47 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 121.831 -0.543 . . . . 0.0 112.464 172.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -140.14 161.19 38.22 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.776 2.03 . . . . 0.0 109.673 169.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -87.78 154.03 20.88 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.766 -0.584 . . . . 0.0 112.548 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.0 m -139.85 146.2 46.03 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 126.542 1.937 . . . . 0.0 111.437 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -65.93 139.6 57.36 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.724 2.282 . . . . 0.0 112.929 -177.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.229 1.012 . . . . 0.0 111.529 171.009 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.4 m . . . . . 0 CA--C 1.546 0.799 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.2 m120 52.35 49.15 21.12 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.706 1.602 . . . . 0.0 110.873 -169.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.73 -36.11 69.35 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -168.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -60.14 -36.58 77.85 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.672 -1.268 . . . . 0.0 113.414 174.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.77 -33.42 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.969 1.308 . . . . 0.0 111.465 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 t -67.44 -47.61 69.67 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.816 0.847 . . . . 0.0 112.21 174.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -60.22 -41.23 92.62 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.824 -1.173 . . . . 0.0 112.049 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -73.69 -30.49 62.91 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.419 1.008 . . . . 0.0 112.661 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 t -60.84 -44.09 97.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -74.63 -33.25 62.52 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.793 -0.567 . . . . 0.0 112.343 176.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -62.35 -30.24 71.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.88 -1.137 . . . . 0.0 111.887 172.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 t -62.85 -33.53 75.44 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 170.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -86.72 -18.93 29.98 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.805 1.242 . . . . 0.0 113.461 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.32 15.62 10.33 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.978 1.751 . . . . 0.0 116.075 173.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -146.96 176.19 10.1 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.526 1.663 . . . . 0.0 114.537 -172.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.53 159.79 33.65 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.328 1.851 . . . . 0.0 111.914 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.61 142.3 13.62 Favored Glycine 0 N--CA 1.474 1.198 0 C-N-CA 124.126 0.87 . . . . 0.0 114.388 -178.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -146.17 160.67 41.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.593 1.557 . . . . 0.0 112.206 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -88.25 137.38 32.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.439 0.696 . . . . 0.0 112.757 171.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.2 mt -71.86 -38.8 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.208 1.803 . . . . 0.0 111.361 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.7 -49.56 0.11 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 126.973 2.225 . . . . 0.0 109.648 -176.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -131.95 -7.88 3.5 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.927 1.291 . . . . 0.0 114.479 169.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -125.59 152.36 45.23 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.062 1.345 . . . . 0.0 113.806 -176.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.1 t -76.43 136.97 39.44 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.565 1.546 . . . . 0.0 114.021 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -133.38 136.41 45.29 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.706 2.402 . . . . 0.0 109.359 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 m -94.86 147.86 22.91 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.24 148.4 51.11 Favored Pre-proline 0 N--CA 1.482 1.137 0 C-N-CA 125.378 1.471 . . . . 0.0 111.996 -176.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -74.04 154.94 47.73 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.879 2.386 . . . . 0.0 113.923 -176.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.333 0 C-N-CA 125.514 1.526 . . . . 0.0 113.037 177.594 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 37.5 t . . . . . 0 CA--C 1.545 0.771 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -74.93 32.66 0.1 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.632 1.573 . . . . 0.0 113.177 174.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.6 tt -56.08 -39.72 72.54 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.982 1.713 . . . . 0.0 112.646 -169.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -63.21 -40.95 98.93 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.233 1.013 . . . . 0.0 112.303 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -74.94 -35.66 62.13 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 118.736 0.698 . . . . 0.0 112.779 173.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.0 m -64.29 -39.93 94.92 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.284 0.493 . . . . 0.0 112.051 175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.83 -34.37 73.0 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.865 -1.147 . . . . 0.0 113.513 176.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 tp -70.74 -44.67 66.33 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.563 1.545 . . . . 0.0 110.12 176.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 t -63.06 -45.07 93.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.738 0.815 . . . . 0.0 112.117 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.5 m -74.28 -27.92 60.96 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.347 -0.846 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 -60.67 -37.51 81.82 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 121.133 -0.979 . . . . 0.0 111.288 167.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.9 m -67.29 -21.74 65.67 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 172.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.8 mt -97.49 -5.26 36.34 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.315 1.446 . . . . 0.0 113.208 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.57 49.02 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.923 1.249 . . . . 0.0 115.924 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.74 168.78 18.89 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 118.938 1.369 . . . . 0.0 113.226 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.9 mt -83.31 143.71 30.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.034 1.334 . . . . 0.0 111.694 -175.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.38 131.9 10.73 Favored Glycine 0 N--CA 1.469 0.834 0 O-C-N 121.537 -0.727 . . . . 0.0 113.278 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -152.98 171.07 18.91 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.792 1.637 . . . . 0.0 111.219 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 64.3 m -122.29 162.03 22.22 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.261 1.424 . . . . 0.0 113.044 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.5 mm -128.16 96.79 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.13 1.772 . . . . 0.0 106.466 168.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.68 -137.93 20.86 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -167.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -76.87 3.19 12.56 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 175.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -121.59 132.23 54.56 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -167.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.4 m -71.18 136.1 47.91 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.587 1.155 . . . . 0.0 113.374 -178.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -150.12 84.08 1.39 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 127.287 2.235 . . . . 0.0 109.886 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -61.62 154.27 25.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.5 m -140.53 156.86 69.19 Favored Pre-proline 0 N--CA 1.488 1.47 0 C-N-CA 126.113 1.765 . . . . 0.0 113.368 -170.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -60.27 147.2 94.56 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 123.803 3.002 . . . . 0.0 116.544 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.228 1.811 . . . . 0.0 113.684 173.77 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 54.26 23.99 4.7 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.885 2.074 . . . . 0.0 115.108 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.7 tp -59.33 -23.89 62.88 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.644 1.178 . . . . 0.0 113.821 -172.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -53.58 -47.24 70.3 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 120.108 1.322 . . . . 0.0 111.624 172.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -71.89 -37.29 70.16 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.017 1.327 . . . . 0.0 113.581 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.71 -46.77 80.9 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 117.946 0.339 . . . . 0.0 111.02 174.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -58.4 -50.58 73.16 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.109 1.364 . . . . 0.0 112.258 175.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.21 -34.85 77.01 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.658 1.572 . . . . 0.0 112.172 -176.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.4 m -63.06 -39.38 94.56 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.08 0.552 . . . . 0.0 111.471 173.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -81.01 -33.71 33.45 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 178.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -68.33 -29.7 68.51 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.326 -1.484 . . . . 0.0 111.905 176.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.6 m -59.38 -27.34 65.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.076 0.95 . . . . 0.0 112.133 169.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -103.31 4.9 36.98 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.508 1.923 . . . . 0.0 113.322 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.04 30.59 46.27 Favored Glycine 0 CA--C 1.538 1.492 0 N-CA-C 116.843 1.497 . . . . 0.0 116.843 174.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -138.87 157.73 45.51 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 120.207 2.004 . . . . 0.0 114.446 177.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 22.9 tp -83.97 144.54 29.08 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.234 1.813 . . . . 0.0 112.305 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.13 145.55 16.29 Favored Glycine 0 CA--C 1.537 1.435 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -137.07 118.04 14.27 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.741 2.017 . . . . 0.0 110.348 169.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 p -71.33 127.23 31.87 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.096 -1.002 . . . . 0.0 110.136 169.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.0 mm -103.4 -33.9 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.206 1.002 . . . . 0.0 111.883 -169.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.2 -110.87 0.42 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.418 1.485 . . . . 0.0 111.154 -170.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -71.95 -27.43 62.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.012 1.325 . . . . 0.0 113.726 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -141.9 135.34 29.37 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.646 1.978 . . . . 0.0 111.458 178.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.8 t -80.01 149.52 30.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.267 1.427 . . . . 0.0 112.318 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.05 162.92 28.75 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.739 1.615 . . . . 0.0 111.257 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -132.52 151.24 51.98 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.778 0.831 . . . . 0.0 112.915 -175.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.9 m -144.78 162.36 38.86 Favored Pre-proline 0 N--CA 1.48 1.067 0 C-N-CA 126.581 1.952 . . . . 0.0 112.531 -169.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.99 142.37 81.16 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 123.106 2.537 . . . . 0.0 114.808 -175.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.401 1.48 . . . . 0.0 114.833 -176.223 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.1 m . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 56.45 30.21 16.66 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 126.515 1.926 . . . . 0.0 113.107 -169.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.03 -29.59 63.5 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -169.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.6 ttp85 -65.15 -45.77 83.63 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.393 1.451 . . . . 0.0 112.003 174.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.78 -40.62 97.88 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.735 0.814 . . . . 0.0 110.525 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.8 t -60.64 -51.72 68.2 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.32 1.448 . . . . 0.0 111.587 175.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.47 -46.78 86.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.37 1.068 . . . . 0.0 113.031 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pp -66.6 -33.53 75.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.941 1.701 . . . . 0.0 111.981 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.5 m -63.85 -46.45 84.95 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.238 0.615 . . . . 0.0 110.981 170.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -77.79 -30.63 51.39 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -61.0 -40.31 93.04 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.111 1.364 . . . . 0.0 110.677 167.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.9 m -67.12 -22.27 65.81 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.797 0.839 . . . . 0.0 113.014 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.72 -14.28 24.93 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.677 1.591 . . . . 0.0 113.782 173.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.79 24.66 24.89 Favored Glycine 0 CA--C 1.542 1.764 0 C-N-CA 125.981 1.753 . . . . 0.0 115.923 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.83 167.87 21.15 Favored 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 119.327 1.564 . . . . 0.0 113.865 -178.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 mt -92.17 136.24 33.35 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.849 1.26 . . . . 0.0 112.76 -170.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.37 149.31 21.84 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.057 0.837 . . . . 0.0 113.839 170.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -153.88 137.84 16.32 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.109 1.763 . . . . 0.0 112.078 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.6 t -83.24 118.18 23.46 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.171 -0.955 . . . . 0.0 110.299 169.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.6 mt -84.17 -35.3 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.824 0.85 . . . . 0.0 110.923 -175.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.8 -68.21 0.13 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.63 1.11 . . . . 0.0 112.67 177.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.69 -24.67 41.58 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.865 -0.786 . . . . 0.0 113.026 175.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -159.96 166.1 30.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.699 1.199 . . . . 0.0 112.398 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.1 t -96.19 133.56 40.36 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.673 1.189 . . . . 0.0 112.437 172.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -133.16 170.71 15.02 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.471 2.308 . . . . 0.0 109.05 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -126.54 154.42 43.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.2 m -146.71 152.39 44.74 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 126.615 1.966 . . . . 0.0 111.757 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.65 146.07 97.08 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 122.784 2.323 . . . . 0.0 113.769 176.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.351 0 C-N-CA 125.545 1.538 . . . . 0.0 111.57 169.768 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -120.29 12.09 11.67 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -169.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.9 t -143.93 114.75 7.74 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.468 1.107 . . . . 0.0 112.956 -176.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -81.58 55.53 2.69 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.515 1.926 . . . . 0.0 110.779 176.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -42.25 -43.57 3.48 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.157 2.183 . . . . 0.0 115.206 -169.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -66.51 -39.47 88.68 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 121.637 2.017 . . . . 0.0 113.869 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -59.09 -38.62 79.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.485 1.514 . . . . 0.0 111.395 170.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 57.9 m -67.24 -48.54 67.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.307 0.643 . . . . 0.0 112.447 172.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.53 -39.22 90.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.129 0.972 . . . . 0.0 112.382 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -74.26 -33.74 63.38 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.936 0.789 . . . . 0.0 112.241 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -63.23 -39.48 94.73 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.405 -0.809 . . . . 0.0 111.39 171.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -70.54 -41.56 72.36 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.768 -0.582 . . . . 0.0 111.792 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -57.0 -41.47 78.53 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.393 0.997 . . . . 0.0 111.022 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.1 m -62.25 -27.41 68.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.331 1.052 . . . . 0.0 113.775 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 tp -86.22 -43.82 12.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.653 1.981 . . . . 0.0 110.422 173.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 150.4 4.67 0.21 Allowed Glycine 0 CA--C 1.534 1.243 0 CA-C-O 117.187 -1.896 . . . . 0.0 117.243 169.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -144.37 177.84 8.35 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.925 2.362 . . . . 0.0 114.516 -168.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.32 159.09 32.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.168 0.987 . . . . 0.0 112.713 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.7 155.5 16.27 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.491 1.044 . . . . 0.0 113.579 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -145.61 150.69 36.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.907 1.683 . . . . 0.0 111.818 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.5 m -77.97 154.15 31.82 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.717 -0.615 . . . . 0.0 111.034 168.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.1 mm -113.33 -37.91 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.982 1.713 . . . . 0.0 110.171 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.77 -111.27 0.39 Allowed Glycine 0 N--CA 1.463 0.47 0 N-CA-C 108.686 -1.765 . . . . 0.0 108.686 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.74 2.73 9.34 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.956 0.902 . . . . 0.0 113.364 168.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -136.52 158.74 43.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.352 2.261 . . . . 0.0 110.425 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.1 p -130.19 152.27 49.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.448 1.499 . . . . 0.0 112.276 173.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -137.91 167.77 21.08 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.53 1.532 . . . . 0.0 112.53 -174.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -109.22 148.76 30.43 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.9 m -144.4 152.64 54.11 Favored Pre-proline 0 N--CA 1.48 1.038 0 C-N-CA 125.636 1.574 . . . . 0.0 113.018 -172.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -61.48 158.7 35.05 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.899 3.066 . . . . 0.0 116.153 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.472 0 C-N-CA 127.163 2.185 . . . . 0.0 115.14 176.838 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 122.551 1.167 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -103.18 46.63 0.91 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.031 1.333 . . . . 0.0 113.752 -172.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.8 m 53.96 19.4 1.99 Allowed 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 118.543 2.794 . . . . 0.0 118.543 168.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 57.11 32.64 22.03 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-N 119.759 1.163 . . . . 0.0 111.748 -166.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.62 -37.27 79.62 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.926 1.69 . . . . 0.0 112.768 -173.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -43.24 78.75 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.514 1.052 . . . . 0.0 110.013 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 54.5 mtt85 -69.89 -36.74 75.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.57 1.548 . . . . 0.0 112.449 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.2 t -65.43 -53.02 49.0 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.533 0.683 . . . . 0.0 111.128 173.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -23.63 59.32 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.031 -1.043 . . . . 0.0 113.365 -172.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.1 tp -59.04 -46.97 86.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.965 1.706 . . . . 0.0 110.905 168.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 t -61.3 -34.24 74.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.684 0.793 . . . . 0.0 111.751 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.98 -41.91 58.6 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.79 1.236 . . . . 0.0 112.657 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -63.79 -31.04 72.09 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.198 1.399 . . . . 0.0 112.158 175.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.0 m -62.81 -4.68 2.24 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.775 1.23 . . . . 0.0 113.647 167.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -122.38 -4.1 8.88 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.175 2.19 . . . . 0.0 112.854 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.43 -6.43 71.33 Favored Glycine 0 CA--C 1.542 1.746 0 C-N-CA 126.777 2.132 . . . . 0.0 116.242 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.83 157.1 35.58 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.912 2.085 . . . . 0.0 112.922 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.1 mt -110.81 151.82 27.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.507 1.523 . . . . 0.0 109.623 169.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.33 157.06 17.0 Favored Glycine 0 N--CA 1.476 1.327 0 CA-C-N 119.349 0.977 . . . . 0.0 114.508 -178.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -146.74 144.74 29.62 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.855 1.662 . . . . 0.0 112.374 173.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.76 122.95 26.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.103 0.561 . . . . 0.0 110.879 171.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.9 mm -81.16 -22.6 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.586 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.48 -68.16 0.5 Allowed Glycine 0 CA--C 1.524 0.651 0 C-N-CA 126.637 2.065 . . . . 0.0 110.685 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -87.58 -19.42 27.84 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.052 1.741 . . . . 0.0 113.083 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -137.17 162.2 34.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.558 1.943 . . . . 0.0 111.425 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.12 151.24 21.19 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.033 1.333 . . . . 0.0 110.046 168.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -138.63 146.86 42.21 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.333 1.053 . . . . 0.0 110.706 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -115.38 154.97 28.24 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.51 1.124 . . . . 0.0 113.221 173.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.6 m -143.46 155.88 60.59 Favored Pre-proline 0 N--CA 1.471 0.603 0 C-N-CA 126.654 1.982 . . . . 0.0 110.775 -173.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -66.09 156.63 63.73 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.551 2.167 . . . . 0.0 113.289 173.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.218 0 C-N-CA 125.218 1.407 . . . . 0.0 113.199 179.774 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.821 0 CA-C-O 120.514 0.197 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -76.43 -178.98 4.9 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.724 1.21 . . . . 0.0 113.513 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.7 p -123.96 23.46 8.57 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.902 2.081 . . . . 0.0 112.987 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.255 4.5 m-80 57.94 23.65 10.1 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.479 2.312 . . . . 0.0 115.907 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -50.93 -37.02 41.63 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.287 1.035 . . . . 0.0 112.708 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -58.22 -33.22 69.08 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -175.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -97.73 -30.24 12.92 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.476 1.035 . . . . 0.0 112.492 172.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -57.01 -48.08 79.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.103 0.961 . . . . 0.0 112.288 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -53.83 -42.11 68.12 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.309 1.044 . . . . 0.0 112.319 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.54 -44.68 70.46 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.248 2.219 . . . . 0.0 111.445 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 t -71.26 -34.7 70.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.783 1.233 . . . . 0.0 112.617 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 57.6 m -71.59 -27.44 63.13 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.487 -0.758 . . . . 0.0 111.608 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -56.64 -31.83 64.73 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.618 1.167 . . . . 0.0 112.212 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.8 t -62.28 -22.58 66.12 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.82 1.248 . . . . 0.0 113.878 174.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.2 mt -105.65 -7.35 18.54 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.934 1.694 . . . . 0.0 113.124 173.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.0 21.35 25.78 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.516 1.531 . . . . 0.0 116.171 173.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.9 167.21 22.52 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.008 1.404 . . . . 0.0 113.278 -177.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.6 mt -79.33 167.59 20.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.453 1.501 . . . . 0.0 112.178 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.51 137.29 14.14 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.859 1.218 . . . . 0.0 111.969 169.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -132.72 138.01 47.09 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.353 1.461 . . . . 0.0 110.735 176.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 89.5 m -70.49 124.88 25.28 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 171.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -110.51 78.68 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 127.37 2.268 . . . . 0.0 106.805 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.42 -124.38 7.18 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 125.932 1.73 . . . . 0.0 112.415 -172.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -74.57 3.18 8.13 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.498 2.319 . . . . 0.0 114.788 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -151.15 136.25 17.5 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.523 1.129 . . . . 0.0 111.674 -166.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -95.24 138.59 32.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.538 0.735 . . . . 0.0 112.711 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -132.19 156.28 46.72 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.494 2.318 . . . . 0.0 110.644 -177.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.4 m -82.67 137.28 34.51 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.591 -0.693 . . . . 0.0 112.399 -175.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 m -136.38 145.27 51.05 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 125.132 1.373 . . . . 0.0 112.776 -173.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.66 151.49 83.34 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.248 2.632 . . . . 0.0 113.752 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.134 1.374 . . . . 0.0 113.752 174.908 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -145.23 149.59 35.19 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.387 1.475 . . . . 0.0 110.748 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.7 m -74.2 94.78 2.5 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.013 0.525 . . . . 0.0 112.348 173.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -83.82 55.05 3.1 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.615 1.166 . . . . 0.0 108.879 170.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 19.3 tp -52.45 -33.1 42.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.703 1.601 . . . . 0.0 115.169 -168.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 66.1 ttp85 -62.73 -48.97 76.9 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.768 1.622 . . . . 0.0 112.571 173.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -65.87 -29.6 70.08 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.603 0.761 . . . . 0.0 112.198 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.5 m -68.84 -51.09 44.29 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.672 0.789 . . . . 0.0 110.88 169.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -60.06 -43.3 95.53 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.165 0.986 . . . . 0.0 112.301 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 pp -69.55 -34.66 74.51 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.003 0.82 . . . . 0.0 111.989 -178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -63.73 -47.35 81.42 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.873 0.869 . . . . 0.0 111.1 171.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.79 -37.23 62.43 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 118.118 0.417 . . . . 0.0 112.089 -176.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -61.33 -33.71 74.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.802 1.241 . . . . 0.0 111.738 173.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 m -67.65 -2.45 6.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 171.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.0 mt -124.08 9.96 8.73 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.268 2.227 . . . . 0.0 112.476 172.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.64 -4.86 62.95 Favored Glycine 0 CA--C 1.541 1.689 0 N-CA-C 116.159 1.224 . . . . 0.0 116.159 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.16 171.12 11.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.347 2.259 . . . . 0.0 113.174 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -123.53 137.05 54.85 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.338 1.855 . . . . 0.0 108.738 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.13 136.31 13.47 Favored Glycine 0 N--CA 1.468 0.82 0 C-N-CA 125.534 1.54 . . . . 0.0 114.583 -176.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -134.42 140.93 46.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.493 1.917 . . . . 0.0 110.881 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.5 t -76.37 140.17 41.29 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.195 -0.941 . . . . 0.0 111.728 169.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.8 mt -85.02 -58.27 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.127 0.971 . . . . 0.0 109.729 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -168.09 -49.37 0.03 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.863 1.697 . . . . 0.0 112.073 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.82 -11.94 6.57 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.623 1.569 . . . . 0.0 113.753 170.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -115.63 149.38 38.4 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.853 1.661 . . . . 0.0 113.181 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.1 m -83.93 147.9 27.23 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.416 1.086 . . . . 0.0 111.951 167.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -131.4 130.09 42.14 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.587 1.955 . . . . 0.0 109.245 170.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.6 m -119.71 136.99 54.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.272 0.629 . . . . 0.0 112.359 177.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -137.95 161.99 56.66 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.846 1.658 . . . . 0.0 110.379 -173.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.83 156.75 41.65 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.388 2.059 . . . . 0.0 113.052 172.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.32 175.329 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 120.431 0.158 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.38 157.24 22.6 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.53 1.532 . . . . 0.0 111.998 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m -114.34 154.2 28.46 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.94 1.296 . . . . 0.0 113.527 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -78.49 40.42 0.37 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.338 1.455 . . . . 0.0 111.211 169.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 15.3 tp -57.15 -31.61 65.54 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.117 1.367 . . . . 0.0 114.331 -167.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -58.85 -35.44 72.93 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.466 1.106 . . . . 0.0 113.124 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -81.79 -35.93 28.98 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.14 1.376 . . . . 0.0 111.642 173.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -61.86 -45.78 92.32 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.164 0.586 . . . . 0.0 112.063 178.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -56.57 -45.91 81.04 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.853 -0.529 . . . . 0.0 111.856 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -70.08 -39.25 75.71 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.868 2.067 . . . . 0.0 111.591 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.3 m -60.44 -46.19 90.95 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.247 1.019 . . . . 0.0 110.868 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.5 m -78.0 -29.66 49.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.527 0.731 . . . . 0.0 112.216 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.66 -38.26 89.63 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 120.375 -1.453 . . . . 0.0 111.255 170.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.5 m -70.01 -14.07 62.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.771 1.229 . . . . 0.0 114.103 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -103.26 -14.95 16.13 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.082 1.353 . . . . 0.0 113.159 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.18 37.28 6.32 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.471 1.51 . . . . 0.0 115.286 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -150.94 163.6 38.31 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 118.976 1.388 . . . . 0.0 113.301 175.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.0 mp -90.6 158.43 16.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.269 1.828 . . . . 0.0 111.883 -172.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.87 154.25 16.47 Favored Glycine 0 N--CA 1.478 1.49 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -151.16 140.22 21.11 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.129 1.772 . . . . 0.0 113.244 173.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.8 t -75.51 138.84 41.82 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 120.787 -1.196 . . . . 0.0 111.992 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.3 mt -142.25 103.33 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 122.33 1.062 . . . . 0.0 112.074 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 -60.16 2.84 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 127.942 2.687 . . . . 0.0 114.582 168.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.26 5.6 0.64 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -159.7 154.62 24.68 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.073 0.851 . . . . 0.0 110.968 -178.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.98 146.64 27.89 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.292 -0.88 . . . . 0.0 112.695 177.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -128.63 158.41 38.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.7 1.6 . . . . 0.0 109.86 171.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 88.2 m -119.16 153.71 34.45 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.734 0.778 . . . . 0.0 112.63 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 m -140.73 151.48 63.23 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 126.287 1.835 . . . . 0.0 111.837 -168.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -65.44 155.98 65.89 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.902 2.401 . . . . 0.0 116.648 -168.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.385 0 C-N-CA 126.824 2.05 . . . . 0.0 114.298 174.919 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -97.93 158.45 15.53 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.334 1.054 . . . . 0.0 113.46 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.9 t -115.07 150.07 36.51 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.773 1.629 . . . . 0.0 111.31 171.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -71.58 34.75 0.06 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.302 1.841 . . . . 0.0 112.524 169.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -49.16 -46.7 45.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.686 1.994 . . . . 0.0 113.737 -167.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -67.9 -37.38 81.65 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -64.25 -42.57 96.45 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.312 1.445 . . . . 0.0 110.988 169.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.0 m -66.03 -43.14 88.49 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.221 0.608 . . . . 0.0 111.888 179.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -62.78 -35.41 79.75 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.884 -1.135 . . . . 0.0 112.58 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 tp -69.67 -37.54 76.73 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.791 1.636 . . . . 0.0 111.027 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.4 t -65.25 -44.51 87.9 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.074 -1.016 . . . . 0.0 111.33 173.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.9 m -70.65 -26.59 63.53 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.143 -0.973 . . . . 0.0 112.222 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -60.63 -24.71 65.75 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.043 -1.036 . . . . 0.0 112.396 170.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.3 p -63.38 -38.9 92.92 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.466 1.03 . . . . 0.0 112.848 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.4 mt -98.39 12.5 34.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.377 1.471 . . . . 0.0 113.045 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.49 22.11 56.99 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.725 1.45 . . . . 0.0 116.725 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.11 -174.56 3.58 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.211 1.506 . . . . 0.0 113.844 -175.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -97.76 156.45 16.56 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.673 1.589 . . . . 0.0 111.905 -174.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.04 150.67 17.14 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 124.723 1.154 . . . . 0.0 114.329 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -137.93 149.47 46.21 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.016 2.126 . . . . 0.0 112.159 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.2 m -91.05 145.5 24.64 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.789 1.236 . . . . 0.0 112.632 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.7 mm -139.83 74.78 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.573 1.549 . . . . 0.0 108.715 169.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.02 -120.06 8.39 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.225 1.393 . . . . 0.0 112.974 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -75.09 -5.53 44.71 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.474 -1.015 . . . . 0.0 113.425 172.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -120.13 177.9 4.83 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.894 1.678 . . . . 0.0 111.717 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 30.1 m -136.09 162.47 32.81 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 125.073 1.349 . . . . 0.0 112.591 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -136.01 175.73 9.33 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.357 2.263 . . . . 0.0 110.767 171.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.4 m -116.14 164.38 14.56 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.581 0.752 . . . . 0.0 110.59 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -142.12 149.21 51.37 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.947 1.699 . . . . 0.0 110.348 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.1 139.58 85.54 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.688 2.259 . . . . 0.0 112.018 177.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.293 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -176.643 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.711 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -80.69 163.43 23.58 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.02 1.328 . . . . 0.0 113.105 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.2 t -68.1 129.61 40.44 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.655 1.182 . . . . 0.0 113.656 -172.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -81.02 54.3 2.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.574 1.549 . . . . 0.0 110.985 168.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.4 tt -47.83 -39.22 17.79 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.939 2.096 . . . . 0.0 112.891 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -59.81 -40.27 87.82 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.705 1.202 . . . . 0.0 113.573 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -71.0 -36.39 72.45 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.078 1.751 . . . . 0.0 111.657 172.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.4 m -66.33 -43.28 86.6 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.191 0.905 . . . . 0.0 112.8 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -62.26 -38.47 89.4 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.035 -1.04 . . . . 0.0 112.547 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.5 -42.51 87.27 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.02 1.728 . . . . 0.0 110.347 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -59.84 -47.91 83.84 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.361 1.065 . . . . 0.0 111.592 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.0 m -74.04 -21.16 60.06 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.958 -1.089 . . . . 0.0 112.931 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -61.76 -22.05 65.07 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.921 -1.112 . . . . 0.0 112.549 169.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 p -74.55 -28.4 60.93 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 170.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.2 mt -90.84 -15.72 29.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.675 1.99 . . . . 0.0 113.319 177.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.13 18.11 11.77 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.527 1.537 . . . . 0.0 116.053 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -155.12 -178.12 7.02 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 119.743 1.772 . . . . 0.0 113.26 -173.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.58 167.19 21.63 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.219 1.408 . . . . 0.0 111.264 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.98 146.04 16.5 Favored Glycine 0 N--CA 1.473 1.145 0 O-C-N 121.029 -1.044 . . . . 0.0 114.915 -174.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -147.24 152.6 38.59 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.962 2.105 . . . . 0.0 110.393 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.8 m -77.74 131.8 37.83 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.123 -0.986 . . . . 0.0 112.301 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.8 mm -130.18 87.1 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-O 122.866 1.317 . . . . 0.0 108.674 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.13 -143.79 31.26 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 113.85 -1.523 . . . . 0.0 112.383 -170.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -74.83 21.74 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -155.83 149.36 24.92 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.665 -1.272 . . . . 0.0 112.304 -175.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.7 m -79.95 135.26 36.36 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 113.297 175.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -117.77 158.96 23.83 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.655 1.982 . . . . 0.0 110.032 167.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.4 m -113.87 149.03 35.68 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -169.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.8 m -135.11 153.06 78.1 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 125.794 1.637 . . . . 0.0 112.041 -170.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -67.77 151.11 79.08 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.813 2.342 . . . . 0.0 115.683 -169.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.607 1.563 . . . . 0.0 113.882 171.501 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.495 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -96.02 153.1 17.95 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.916 1.286 . . . . 0.0 112.791 -174.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.3 t -82.52 148.42 28.11 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.473 0.709 . . . . 0.0 112.862 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -81.28 49.76 1.33 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.549 1.939 . . . . 0.0 112.036 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.4 tp -61.81 -40.77 96.41 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -172.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -66.48 -33.43 75.67 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.1 1.318 . . . . 0.0 112.061 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -73.64 -38.64 64.95 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.908 0.883 . . . . 0.0 112.224 168.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -59.17 -42.22 90.29 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.024 0.829 . . . . 0.0 111.563 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.38 -47.52 78.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.168 0.987 . . . . 0.0 112.632 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.3 tp -73.06 -29.99 63.37 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.862 1.665 . . . . 0.0 112.119 -177.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.0 t -63.94 -36.87 85.37 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.433 1.093 . . . . 0.0 111.649 169.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.47 -30.93 33.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.273 -0.892 . . . . 0.0 113.008 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -52.26 -36.63 53.15 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.003 0.921 . . . . 0.0 111.57 169.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 p -57.44 -28.63 63.5 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.4 mt -104.38 5.47 34.4 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.56 1.944 . . . . 0.0 113.698 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.14 12.42 67.98 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.57 178.24 7.15 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.594 1.697 . . . . 0.0 112.608 -177.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.0 mt -83.03 160.33 21.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.588 1.155 . . . . 0.0 111.906 -176.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.9 153.0 17.57 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 123.83 0.729 . . . . 0.0 112.672 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -149.88 132.07 15.44 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.87 0.868 . . . . 0.0 111.679 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.5 t -86.18 124.77 32.95 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.79 0.436 . . . . 0.0 110.611 169.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.19 33.82 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.811 1.644 . . . . 0.0 110.553 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.34 -64.5 1.36 Allowed Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.769 1.652 . . . . 0.0 113.317 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -74.83 -33.87 62.23 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.276 1.43 . . . . 0.0 113.504 -176.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -158.79 155.3 27.66 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.466 1.106 . . . . 0.0 112.593 -168.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -83.69 143.93 29.72 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.604 1.162 . . . . 0.0 111.355 169.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -151.09 161.08 43.4 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.185 1.394 . . . . 0.0 111.959 167.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 m -94.7 150.42 20.24 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -141.97 148.48 48.98 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 125.774 1.63 . . . . 0.0 111.136 -173.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -65.61 138.07 52.79 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.203 2.602 . . . . 0.0 113.965 -172.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.073 1.749 . . . . 0.0 113.746 179.561 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -65.6 146.91 54.24 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.445 0.641 . . . . 0.0 112.315 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.7 p -67.36 144.49 55.78 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 122.278 1.037 . . . . 0.0 113.485 178.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -79.1 49.85 0.99 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 128.312 2.645 . . . . 0.0 111.612 177.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -47.48 -37.82 12.58 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.972 1.309 . . . . 0.0 113.445 -170.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -57.46 -45.06 85.19 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.175 0.99 . . . . 0.0 113.63 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.13 -37.26 66.72 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.173 1.789 . . . . 0.0 110.889 173.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 64.2 m -60.48 -43.37 97.05 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.413 0.685 . . . . 0.0 112.826 175.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -56.27 -47.04 79.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.534 1.061 . . . . 0.0 110.947 172.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tp -63.21 -39.53 94.88 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.566 1.546 . . . . 0.0 111.503 177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 m -63.06 -37.82 88.73 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.503 1.521 . . . . 0.0 113.186 171.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 64.5 m -78.08 -34.92 49.98 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.627 -0.671 . . . . 0.0 111.904 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -30.53 71.36 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.857 -1.152 . . . . 0.0 111.762 176.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.7 t -63.24 -41.64 99.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 0.0 111.676 168.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.15 -6.41 54.69 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.151 1.38 . . . . 0.0 113.662 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.54 13.15 56.09 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 125.981 1.753 . . . . 0.0 115.79 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -141.63 171.86 13.48 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.898 1.349 . . . . 0.0 113.404 -175.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.4 mt -75.07 151.09 38.69 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 112.289 -173.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.34 136.88 12.94 Favored Glycine 0 N--CA 1.471 0.98 0 O-C-N 121.409 -0.807 . . . . 0.0 112.864 173.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -143.55 166.93 23.46 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.848 1.659 . . . . 0.0 110.874 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 t -150.07 153.43 36.42 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -173.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -129.48 103.07 8.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 126.349 1.859 . . . . 0.0 107.53 167.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.03 -102.3 0.34 Allowed Glycine 0 CA--C 1.534 1.278 0 C-N-CA 127.087 2.28 . . . . 0.0 114.533 176.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.03 10.48 28.88 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.816 2.047 . . . . 0.0 113.034 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -143.15 115.6 8.55 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.138 -1.601 . . . . 0.0 113.677 -173.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.2 m -84.6 138.91 32.45 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.66 1.584 . . . . 0.0 112.311 169.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.17 135.88 26.0 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.354 1.462 . . . . 0.0 110.495 169.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 m -78.32 153.43 31.73 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.9 m -141.82 148.95 51.43 Favored Pre-proline 0 N--CA 1.478 0.942 0 C-N-CA 124.856 1.263 . . . . 0.0 112.054 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_exo -67.67 161.74 42.38 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.658 2.239 . . . . 0.0 112.961 170.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.258 1.533 0 C-N-CA 124.748 1.219 . . . . 0.0 112.765 174.179 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.138 0.494 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 57.15 30.45 18.34 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 115.629 1.715 . . . . 0.0 115.629 169.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.8 p -82.95 -1.14 51.62 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -178.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.9 m120 51.73 32.92 10.12 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 127.511 2.324 . . . . 0.0 114.897 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.7 -31.0 24.3 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 -168.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -59.02 -40.19 84.24 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.12 1.327 . . . . 0.0 112.245 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 mmm180 -70.34 -39.78 74.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.469 1.107 . . . . 0.0 111.569 174.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.3 m -67.62 -43.7 79.77 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.269 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.42 -34.72 78.85 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.196 -0.94 . . . . 0.0 113.194 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tp -66.93 -36.69 82.8 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 110.393 171.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.9 m -66.88 -42.44 85.56 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.463 -0.773 . . . . 0.0 111.397 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.96 -36.86 75.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.879 0.763 . . . . 0.0 111.669 175.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -54.65 -40.71 69.28 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.995 -1.065 . . . . 0.0 111.163 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.1 m -75.01 3.27 8.66 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.885 1.674 . . . . 0.0 114.693 176.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -123.9 2.47 8.74 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.008 2.123 . . . . 0.0 112.271 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.35 19.53 66.41 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 125.387 1.47 . . . . 0.0 115.884 177.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -139.9 173.32 11.64 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.81 1.805 . . . . 0.0 112.747 -177.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.6 mt -86.58 176.74 7.65 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.164 1.386 . . . . 0.0 111.553 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -154.46 153.92 25.15 Favored Glycine 0 N--CA 1.474 1.171 0 O-C-N 120.902 -1.124 . . . . 0.0 115.128 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -141.32 147.43 38.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.446 1.498 . . . . 0.0 112.226 -174.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.1 t -81.64 133.85 35.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.747 0.819 . . . . 0.0 112.178 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.0 mt -122.32 65.08 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 127.075 2.15 . . . . 0.0 108.877 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.95 -69.73 0.78 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 127.209 2.337 . . . . 0.0 115.016 176.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -100.74 -18.03 16.67 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.031 1.332 . . . . 0.0 112.954 -174.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -146.52 176.32 9.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 126.371 1.868 . . . . 0.0 112.143 -169.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 29.6 p -126.82 142.68 51.48 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.896 1.278 . . . . 0.0 111.396 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -135.6 150.73 49.76 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.151 0.98 . . . . 0.0 111.853 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 m -79.55 155.03 28.38 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 169.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -143.51 151.0 53.1 Favored Pre-proline 0 N--CA 1.476 0.852 0 C-N-CA 126.206 1.803 . . . . 0.0 111.039 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -59.2 146.7 93.68 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.192 2.595 . . . . 0.0 114.954 -173.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.966 1.706 . . . . 0.0 112.487 173.41 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -83.46 -11.91 56.96 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 170.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m -69.38 100.71 1.41 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.979 1.312 . . . . 0.0 108.06 166.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.42 45.53 0.67 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.54 1.536 . . . . 0.0 111.14 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.48 -38.49 44.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.463 2.305 . . . . 0.0 113.063 -168.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -64.31 -35.35 80.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.313 -0.867 . . . . 0.0 112.773 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -85.56 -32.15 22.29 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.359 1.464 . . . . 0.0 113.545 171.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -68.46 -35.46 77.59 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.089 0.859 . . . . 0.0 112.354 176.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.23 -36.47 66.05 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.194 -1.566 . . . . 0.0 111.954 169.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.4 tp -82.05 -37.78 25.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.06 1.744 . . . . 0.0 111.37 -177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 83.6 p -65.0 -41.81 95.06 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.474 1.033 . . . . 0.0 111.179 175.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.25 -41.92 84.81 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.008 -0.432 . . . . 0.0 110.425 174.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -61.86 -33.35 74.03 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.811 -1.181 . . . . 0.0 112.402 176.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 41.7 t -66.4 -29.35 69.48 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.064 0.946 . . . . 0.0 112.658 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.79 -48.04 17.51 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.92 -1.112 . . . . 0.0 111.126 170.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 144.65 15.71 0.22 Allowed Glycine 0 CA--C 1.537 1.453 0 CA-C-O 117.82 -1.544 . . . . 0.0 116.098 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.94 179.53 7.41 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 120.202 2.001 . . . . 0.0 113.132 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.3 mt -88.46 160.05 17.7 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.851 -1.155 . . . . 0.0 112.844 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.26 138.7 15.14 Favored Glycine 0 N--CA 1.469 0.881 0 C-N-CA 124.295 0.95 . . . . 0.0 113.801 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -141.7 171.25 14.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.354 2.261 . . . . 0.0 109.826 172.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.0 t -150.06 139.01 20.99 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 -174.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.8 mm -117.91 115.41 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.468 1.907 . . . . 0.0 110.57 -174.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -87.03 0.18 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 126.139 1.828 . . . . 0.0 111.676 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 50.0 mp0 -129.42 5.23 5.18 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.17 1.788 . . . . 0.0 112.71 172.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -115.77 117.17 29.49 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.169 0.988 . . . . 0.0 113.163 -168.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.0 m -74.36 138.98 43.78 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 120.569 -1.332 . . . . 0.0 113.153 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -147.13 127.22 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.793 1.637 . . . . 0.0 111.285 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.8 m -77.65 147.69 35.42 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -130.18 148.29 69.15 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 126.532 1.933 . . . . 0.0 110.64 -175.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -65.26 145.29 83.51 Favored 'Trans proline' 0 C--O 1.239 0.547 0 C-N-CA 122.44 2.094 . . . . 0.0 112.901 -171.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 C-N-CA 125.493 1.517 . . . . 0.0 111.158 177.138 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 120.689 0.281 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -88.63 154.13 20.57 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.238 1.015 . . . . 0.0 113.281 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.5 t -154.1 162.85 40.91 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 126.152 1.781 . . . . 0.0 111.278 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -111.65 66.5 0.63 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.196 1.798 . . . . 0.0 111.401 -168.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.56 -42.08 15.32 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.207 1.803 . . . . 0.0 114.073 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -65.43 -34.04 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 120.24 -1.538 . . . . 0.0 113.519 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -73.1 -38.14 66.48 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.955 0.902 . . . . 0.0 111.29 172.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.7 t -62.65 -40.84 98.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.473 1.109 . . . . 0.0 112.098 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -58.25 -41.54 84.46 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.864 1.265 . . . . 0.0 112.446 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.2 tp -69.71 -42.71 73.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.377 0.989 . . . . 0.0 110.125 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.9 t -57.82 -39.02 76.62 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.788 -0.57 . . . . 0.0 112.485 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.4 m -79.67 -32.92 41.55 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.474 -0.766 . . . . 0.0 112.975 175.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -60.49 -29.65 69.21 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.644 -1.285 . . . . 0.0 112.539 170.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.6 p -67.64 -14.47 62.97 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 172.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -103.24 -24.71 13.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.151 1.78 . . . . 0.0 112.502 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.01 2.14 28.38 Favored Glycine 0 CA--C 1.542 1.759 0 C-N-CA 125.905 1.717 . . . . 0.0 116.076 174.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -121.24 171.96 8.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.983 1.713 . . . . 0.0 112.347 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -73.74 154.31 39.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.952 1.301 . . . . 0.0 112.117 -173.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.95 141.89 15.61 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 123.933 0.778 . . . . 0.0 113.938 175.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -138.2 153.39 49.16 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.602 1.561 . . . . 0.0 111.729 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 m -100.19 95.28 6.71 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.247 1.419 . . . . 0.0 110.183 172.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -82.86 68.65 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-O 123.204 1.478 . . . . 0.0 110.146 -176.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.84 -92.33 0.19 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 127.083 2.278 . . . . 0.0 111.879 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -66.78 -28.61 68.53 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 -177.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -155.96 168.06 28.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.75 1.613 . . . . 0.0 114.739 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 t -70.92 132.8 45.77 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.932 0.893 . . . . 0.0 112.712 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -140.07 139.24 35.86 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.15 1.38 . . . . 0.0 110.12 168.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.6 m -87.19 152.69 22.1 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.825 -0.547 . . . . 0.0 112.24 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -138.79 151.8 69.25 Favored Pre-proline 0 N--CA 1.48 1.03 0 C-N-CA 125.088 1.355 . . . . 0.0 111.848 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -65.23 130.5 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 122.713 2.275 . . . . 0.0 111.293 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.404 0 C-N-CA 124.807 1.243 . . . . 0.0 113.417 -174.635 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 119.696 -0.192 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -117.2 5.02 12.65 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.053 1.341 . . . . 0.0 114.303 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.3 p -66.02 164.19 15.77 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.061 1.745 . . . . 0.0 112.789 176.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -84.93 44.2 1.05 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.543 1.937 . . . . 0.0 112.754 -176.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.97 -39.61 90.52 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.36 1.464 . . . . 0.0 113.062 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -44.51 68.91 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.244 1.418 . . . . 0.0 110.865 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -69.28 -38.06 78.18 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.978 1.711 . . . . 0.0 112.97 172.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.75 -41.43 97.66 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.502 0.592 . . . . 0.0 112.478 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -63.06 -34.74 78.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.22 -0.925 . . . . 0.0 112.288 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -45.29 65.49 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.738 2.415 . . . . 0.0 110.839 174.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.0 t -58.4 -48.95 79.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.568 1.147 . . . . 0.0 111.509 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -70.88 -31.94 68.75 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.381 -0.824 . . . . 0.0 111.871 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -60.89 -24.79 66.24 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.618 -1.301 . . . . 0.0 113.244 169.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 p -61.84 -28.91 69.82 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.279 1.399 . . . . 0.0 112.326 173.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.06 -2.5 27.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.222 2.209 . . . . 0.0 113.404 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.63 30.83 20.32 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 174.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.5 171.87 13.46 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 119.812 1.806 . . . . 0.0 113.73 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.3 mt -79.25 170.96 15.85 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.977 1.711 . . . . 0.0 112.291 -175.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.99 146.58 17.94 Favored Glycine 0 CA--C 1.537 1.411 0 N-CA-C 115.401 0.92 . . . . 0.0 115.401 -175.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -140.6 156.33 46.31 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.593 2.357 . . . . 0.0 111.508 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.1 p -110.05 55.4 0.64 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.108 1.363 . . . . 0.0 112.512 174.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.9 mm -55.49 -47.6 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.297 1.439 . . . . 0.0 113.446 -168.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -107.9 41.66 2.15 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.652 1.596 . . . . 0.0 112.257 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 64.21 -33.4 0.14 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 127.37 2.268 . . . . 0.0 114.837 -169.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -79.59 150.78 30.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.951 1.701 . . . . 0.0 112.096 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -65.16 131.68 47.17 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -176.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -129.14 128.5 43.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.255 2.222 . . . . 0.0 109.099 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 27.9 m -85.1 147.52 26.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 174.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.3 m -137.07 149.3 65.88 Favored Pre-proline 0 N--CA 1.479 1.011 0 C-N-CA 124.912 1.285 . . . . 0.0 112.107 -170.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.04 137.72 38.29 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 123.297 2.665 . . . . 0.0 114.404 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 C-N-CA 126.574 1.95 . . . . 0.0 113.114 -178.971 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 110.55 -0.167 . . . . 0.0 110.55 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -88.22 64.1 7.5 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.559 1.944 . . . . 0.0 110.058 -176.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.3 m -53.47 143.02 20.5 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 -166.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.41 36.62 0.43 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.507 1.923 . . . . 0.0 112.492 174.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mt -55.87 -48.01 76.34 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.021 1.328 . . . . 0.0 113.453 -170.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.7 ttp85 -63.8 -34.81 78.74 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.656 -1.278 . . . . 0.0 111.341 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -72.08 -34.31 68.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 126.883 2.073 . . . . 0.0 113.906 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.91 -40.38 28.35 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.782 0.719 . . . . 0.0 112.127 175.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -53.39 -35.07 59.96 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.63 1.572 . . . . 0.0 112.974 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.32 -31.6 72.49 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.591 1.087 . . . . 0.0 112.994 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.0 t -77.6 -39.33 45.9 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.409 1.084 . . . . 0.0 111.07 171.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.9 m -66.3 -38.64 88.22 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.084 -1.01 . . . . 0.0 111.372 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -43.48 89.82 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.52 1.128 . . . . 0.0 111.196 170.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -59.3 -32.89 70.46 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.484 0.714 . . . . 0.0 112.872 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 97.0 mt -91.17 -4.8 55.8 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.006 1.722 . . . . 0.0 113.632 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 29.88 57.74 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.711 1.624 . . . . 0.0 115.907 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.31 178.43 7.42 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 118.42 1.11 . . . . 0.0 112.489 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -91.58 147.62 22.87 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.975 -1.078 . . . . 0.0 112.415 -169.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -88.77 137.39 14.22 Favored Glycine 0 CA--C 1.533 1.167 0 O-C-N 121.462 -0.773 . . . . 0.0 112.368 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -145.26 137.02 25.47 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.701 1.2 . . . . 0.0 111.023 176.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -81.67 73.68 8.7 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.415 -0.803 . . . . 0.0 110.901 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 pt -64.12 -17.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -170.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.17 115.84 0.34 Allowed Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.458 1.028 . . . . 0.0 111.908 169.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 61.99 -35.74 0.11 Allowed 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 128.951 2.9 . . . . 0.0 115.889 -172.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -139.17 158.01 44.93 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 127.556 2.342 . . . . 0.0 110.644 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -87.21 140.79 29.19 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.033 1.123 . . . . 0.0 114.033 -178.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -134.44 156.67 48.15 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.996 1.719 . . . . 0.0 108.982 168.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 5.6 m -85.05 144.71 28.08 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.054 -0.404 . . . . 0.0 111.436 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.7 m -135.93 148.19 64.02 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 125.81 1.644 . . . . 0.0 111.016 -173.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.16 151.67 72.48 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.661 2.241 . . . . 0.0 111.382 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.337 0 C-N-CA 125.19 1.396 . . . . 0.0 112.073 174.989 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.9 0.381 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -57.82 157.92 6.97 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.651 1.18 . . . . 0.0 113.007 177.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.3 t -68.35 -3.02 9.64 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -169.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 m120 56.65 47.51 18.24 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.415 2.286 . . . . 0.0 111.654 -169.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.0 tt -53.86 -34.64 59.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.461 1.504 . . . . 0.0 113.193 -174.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.8 ttp180 -69.06 -32.85 72.61 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.762 0.825 . . . . 0.0 112.287 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -69.64 -43.69 72.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.655 1.182 . . . . 0.0 110.432 170.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -58.34 -49.26 77.85 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.864 176.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.11 -41.92 84.62 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.889 0.876 . . . . 0.0 113.191 174.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.72 -39.88 95.39 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.953 1.301 . . . . 0.0 110.802 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 p -59.88 -36.73 77.55 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.605 -0.684 . . . . 0.0 112.253 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.4 m -85.6 -37.01 20.01 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.99 0.916 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -56.8 -39.61 74.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.883 1.673 . . . . 0.0 112.067 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 m -62.36 -23.15 66.64 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.186 0.994 . . . . 0.0 113.108 175.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.7 mt -103.79 7.05 37.08 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 127.649 2.38 . . . . 0.0 113.714 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.5 23.07 61.14 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 125.099 1.333 . . . . 0.0 116.287 174.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.84 176.76 9.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.749 1.775 . . . . 0.0 113.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.8 mt -91.23 151.98 20.7 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.802 0.841 . . . . 0.0 112.537 -169.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.96 142.82 16.19 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.285 0.945 . . . . 0.0 114.314 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -134.57 114.36 12.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.324 1.45 . . . . 0.0 109.321 177.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -105.88 117.43 34.02 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.229 1.012 . . . . 0.0 110.719 -171.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -83.06 -45.7 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 124.354 1.061 . . . . 0.0 111.142 -170.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.57 107.0 0.79 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 126.442 1.973 . . . . 0.0 109.078 -169.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 60.68 4.99 0.83 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.055 1.742 . . . . 0.0 115.606 -167.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -149.8 147.32 27.86 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.446 1.498 . . . . 0.0 112.351 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.5 t -127.27 143.76 51.18 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.387 1.875 . . . . 0.0 110.833 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -136.07 159.11 42.73 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.674 1.99 . . . . 0.0 109.739 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 m -101.31 152.4 20.74 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.1 m -133.55 144.95 54.32 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.661 1.585 . . . . 0.0 111.969 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -62.17 150.39 86.93 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.187 2.592 . . . . 0.0 113.879 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.377 0 C-N-CA 125.072 1.349 . . . . 0.0 112.075 174.369 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -146.79 34.54 0.93 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.569 1.148 . . . . 0.0 114.015 -168.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.9 t -71.15 146.58 49.06 Favored 'General case' 0 CA--C 1.55 0.947 0 O-C-N 120.972 -1.08 . . . . 0.0 113.778 -172.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -85.27 39.56 0.78 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 -173.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -49.49 -47.28 48.68 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.455 1.502 . . . . 0.0 114.776 -171.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -66.05 -37.09 84.96 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.107 1.322 . . . . 0.0 113.608 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -74.55 -37.93 62.87 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.44 1.096 . . . . 0.0 111.729 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.1 t -63.95 -44.88 91.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.528 1.131 . . . . 0.0 111.876 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -56.38 -35.59 67.9 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.207 1.003 . . . . 0.0 113.332 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.6 tp -71.2 -34.08 70.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 110.877 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -72.43 -41.22 66.43 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.792 -1.192 . . . . 0.0 112.192 172.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.6 m -68.45 -29.71 68.42 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.023 -1.048 . . . . 0.0 111.468 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.43 -37.16 74.81 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.203 1.001 . . . . 0.0 111.381 168.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.4 p -67.49 -17.85 64.84 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.7 mt -107.72 1.66 23.19 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.18 2.192 . . . . 0.0 112.783 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.43 28.37 69.79 Favored Glycine 0 CA--C 1.539 1.578 0 O-C-N 120.82 -1.175 . . . . 0.0 115.833 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -142.41 -178.27 5.67 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 119.109 1.454 . . . . 0.0 112.723 178.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 mt -88.79 148.77 23.75 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.64 1.176 . . . . 0.0 112.083 -173.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -92.34 141.11 15.44 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.187 -0.785 . . . . 0.0 111.984 168.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -148.77 129.95 14.56 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.373 1.069 . . . . 0.0 112.982 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.7 m -84.17 118.78 24.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 112.34 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.1 mm -147.69 125.0 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.938 1.695 . . . . 0.0 109.801 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.05 47.37 13.5 Favored Glycine 0 CA--C 1.534 1.25 0 O-C-N 121.646 -0.659 . . . . 0.0 113.872 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 65.74 6.64 4.02 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.27 2.228 . . . . 0.0 116.486 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -146.2 151.66 37.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.238 1.015 . . . . 0.0 113.012 173.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -79.85 142.19 35.47 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 121.831 -0.543 . . . . 0.0 112.464 172.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -140.14 161.19 38.22 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.776 2.03 . . . . 0.0 109.673 169.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -87.78 154.03 20.88 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.766 -0.584 . . . . 0.0 112.548 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.0 m -139.85 146.2 46.03 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 126.542 1.937 . . . . 0.0 111.437 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -65.93 139.6 57.36 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.724 2.282 . . . . 0.0 112.929 -177.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.229 1.012 . . . . 0.0 111.529 171.009 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 119.657 -0.211 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 52.77 27.06 4.97 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -179.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.4 m -76.18 21.61 0.17 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 -169.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.2 m120 52.35 49.15 21.12 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.706 1.602 . . . . 0.0 110.873 -169.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.73 -36.11 69.35 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -168.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -60.14 -36.58 77.85 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.672 -1.268 . . . . 0.0 113.414 174.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.77 -33.42 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.969 1.308 . . . . 0.0 111.465 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 t -67.44 -47.61 69.67 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.816 0.847 . . . . 0.0 112.21 174.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -60.22 -41.23 92.62 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.824 -1.173 . . . . 0.0 112.049 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -73.69 -30.49 62.91 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.419 1.008 . . . . 0.0 112.661 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 t -60.84 -44.09 97.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -74.63 -33.25 62.52 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.793 -0.567 . . . . 0.0 112.343 176.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -62.35 -30.24 71.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.88 -1.137 . . . . 0.0 111.887 172.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 t -62.85 -33.53 75.44 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 170.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -86.72 -18.93 29.98 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.805 1.242 . . . . 0.0 113.461 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.32 15.62 10.33 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.978 1.751 . . . . 0.0 116.075 173.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -146.96 176.19 10.1 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.526 1.663 . . . . 0.0 114.537 -172.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.53 159.79 33.65 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.328 1.851 . . . . 0.0 111.914 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.61 142.3 13.62 Favored Glycine 0 N--CA 1.474 1.198 0 C-N-CA 124.126 0.87 . . . . 0.0 114.388 -178.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -146.17 160.67 41.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.593 1.557 . . . . 0.0 112.206 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -88.25 137.38 32.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.439 0.696 . . . . 0.0 112.757 171.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.2 mt -71.86 -38.8 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.208 1.803 . . . . 0.0 111.361 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.7 -49.56 0.11 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 126.973 2.225 . . . . 0.0 109.648 -176.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -131.95 -7.88 3.5 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.927 1.291 . . . . 0.0 114.479 169.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -125.59 152.36 45.23 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.062 1.345 . . . . 0.0 113.806 -176.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.1 t -76.43 136.97 39.44 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.565 1.546 . . . . 0.0 114.021 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -133.38 136.41 45.29 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.706 2.402 . . . . 0.0 109.359 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 m -94.86 147.86 22.91 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.24 148.4 51.11 Favored Pre-proline 0 N--CA 1.482 1.137 0 C-N-CA 125.378 1.471 . . . . 0.0 111.996 -176.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -74.04 154.94 47.73 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.879 2.386 . . . . 0.0 113.923 -176.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.333 0 C-N-CA 125.514 1.526 . . . . 0.0 113.037 177.594 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 119.555 -0.26 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -66.15 145.36 55.89 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 172.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 37.5 t -137.59 152.62 49.59 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.032 1.333 . . . . 0.0 112.129 -179.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -74.93 32.66 0.1 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.632 1.573 . . . . 0.0 113.177 174.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.6 tt -56.08 -39.72 72.54 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.982 1.713 . . . . 0.0 112.646 -169.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -63.21 -40.95 98.93 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.233 1.013 . . . . 0.0 112.303 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -74.94 -35.66 62.13 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 118.736 0.698 . . . . 0.0 112.779 173.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.0 m -64.29 -39.93 94.92 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.284 0.493 . . . . 0.0 112.051 175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.83 -34.37 73.0 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.865 -1.147 . . . . 0.0 113.513 176.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 tp -70.74 -44.67 66.33 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.563 1.545 . . . . 0.0 110.12 176.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 t -63.06 -45.07 93.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.738 0.815 . . . . 0.0 112.117 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.5 m -74.28 -27.92 60.96 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.347 -0.846 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 -60.67 -37.51 81.82 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 121.133 -0.979 . . . . 0.0 111.288 167.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.9 m -67.29 -21.74 65.67 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 172.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.8 mt -97.49 -5.26 36.34 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.315 1.446 . . . . 0.0 113.208 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.57 49.02 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.923 1.249 . . . . 0.0 115.924 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.74 168.78 18.89 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 118.938 1.369 . . . . 0.0 113.226 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.9 mt -83.31 143.71 30.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.034 1.334 . . . . 0.0 111.694 -175.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.38 131.9 10.73 Favored Glycine 0 N--CA 1.469 0.834 0 O-C-N 121.537 -0.727 . . . . 0.0 113.278 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -152.98 171.07 18.91 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.792 1.637 . . . . 0.0 111.219 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 64.3 m -122.29 162.03 22.22 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.261 1.424 . . . . 0.0 113.044 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.5 mm -128.16 96.79 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.13 1.772 . . . . 0.0 106.466 168.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.68 -137.93 20.86 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -167.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -76.87 3.19 12.56 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 175.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -121.59 132.23 54.56 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -167.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.4 m -71.18 136.1 47.91 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.587 1.155 . . . . 0.0 113.374 -178.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -150.12 84.08 1.39 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 127.287 2.235 . . . . 0.0 109.886 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -61.62 154.27 25.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.5 m -140.53 156.86 69.19 Favored Pre-proline 0 N--CA 1.488 1.47 0 C-N-CA 126.113 1.765 . . . . 0.0 113.368 -170.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -60.27 147.2 94.56 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 123.803 3.002 . . . . 0.0 116.544 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.228 1.811 . . . . 0.0 113.684 173.77 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -65.13 137.85 57.91 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.471 0.708 . . . . 0.0 112.274 174.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.5 p -156.11 23.33 0.37 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.293 1.437 . . . . 0.0 113.324 -177.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 54.26 23.99 4.7 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.885 2.074 . . . . 0.0 115.108 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.7 tp -59.33 -23.89 62.88 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.644 1.178 . . . . 0.0 113.821 -172.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -53.58 -47.24 70.3 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 120.108 1.322 . . . . 0.0 111.624 172.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -71.89 -37.29 70.16 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.017 1.327 . . . . 0.0 113.581 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.71 -46.77 80.9 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 117.946 0.339 . . . . 0.0 111.02 174.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -58.4 -50.58 73.16 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.109 1.364 . . . . 0.0 112.258 175.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.21 -34.85 77.01 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.658 1.572 . . . . 0.0 112.172 -176.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.4 m -63.06 -39.38 94.56 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.08 0.552 . . . . 0.0 111.471 173.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -81.01 -33.71 33.45 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 178.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -68.33 -29.7 68.51 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.326 -1.484 . . . . 0.0 111.905 176.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.6 m -59.38 -27.34 65.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.076 0.95 . . . . 0.0 112.133 169.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -103.31 4.9 36.98 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.508 1.923 . . . . 0.0 113.322 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.04 30.59 46.27 Favored Glycine 0 CA--C 1.538 1.492 0 N-CA-C 116.843 1.497 . . . . 0.0 116.843 174.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -138.87 157.73 45.51 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 120.207 2.004 . . . . 0.0 114.446 177.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 22.9 tp -83.97 144.54 29.08 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.234 1.813 . . . . 0.0 112.305 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.13 145.55 16.29 Favored Glycine 0 CA--C 1.537 1.435 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -137.07 118.04 14.27 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.741 2.017 . . . . 0.0 110.348 169.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 p -71.33 127.23 31.87 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.096 -1.002 . . . . 0.0 110.136 169.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.0 mm -103.4 -33.9 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.206 1.002 . . . . 0.0 111.883 -169.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.2 -110.87 0.42 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.418 1.485 . . . . 0.0 111.154 -170.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -71.95 -27.43 62.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.012 1.325 . . . . 0.0 113.726 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -141.9 135.34 29.37 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.646 1.978 . . . . 0.0 111.458 178.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.8 t -80.01 149.52 30.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.267 1.427 . . . . 0.0 112.318 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.05 162.92 28.75 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.739 1.615 . . . . 0.0 111.257 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -132.52 151.24 51.98 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.778 0.831 . . . . 0.0 112.915 -175.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.9 m -144.78 162.36 38.86 Favored Pre-proline 0 N--CA 1.48 1.067 0 C-N-CA 126.581 1.952 . . . . 0.0 112.531 -169.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.99 142.37 81.16 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 123.106 2.537 . . . . 0.0 114.808 -175.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.401 1.48 . . . . 0.0 114.833 -176.223 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.889 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -63.09 137.21 58.18 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.1 m -77.85 14.02 1.2 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.509 1.524 . . . . 0.0 114.871 -178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 56.45 30.21 16.66 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 126.515 1.926 . . . . 0.0 113.107 -169.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.03 -29.59 63.5 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -169.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.6 ttp85 -65.15 -45.77 83.63 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.393 1.451 . . . . 0.0 112.003 174.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.78 -40.62 97.88 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.735 0.814 . . . . 0.0 110.525 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.8 t -60.64 -51.72 68.2 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.32 1.448 . . . . 0.0 111.587 175.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.47 -46.78 86.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.37 1.068 . . . . 0.0 113.031 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pp -66.6 -33.53 75.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.941 1.701 . . . . 0.0 111.981 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.5 m -63.85 -46.45 84.95 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.238 0.615 . . . . 0.0 110.981 170.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -77.79 -30.63 51.39 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -61.0 -40.31 93.04 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.111 1.364 . . . . 0.0 110.677 167.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.9 m -67.12 -22.27 65.81 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.797 0.839 . . . . 0.0 113.014 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.72 -14.28 24.93 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.677 1.591 . . . . 0.0 113.782 173.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.79 24.66 24.89 Favored Glycine 0 CA--C 1.542 1.764 0 C-N-CA 125.981 1.753 . . . . 0.0 115.923 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.83 167.87 21.15 Favored 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 119.327 1.564 . . . . 0.0 113.865 -178.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 mt -92.17 136.24 33.35 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.849 1.26 . . . . 0.0 112.76 -170.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.37 149.31 21.84 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.057 0.837 . . . . 0.0 113.839 170.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -153.88 137.84 16.32 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.109 1.763 . . . . 0.0 112.078 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.6 t -83.24 118.18 23.46 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.171 -0.955 . . . . 0.0 110.299 169.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.6 mt -84.17 -35.3 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.824 0.85 . . . . 0.0 110.923 -175.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.8 -68.21 0.13 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.63 1.11 . . . . 0.0 112.67 177.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.69 -24.67 41.58 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.865 -0.786 . . . . 0.0 113.026 175.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -159.96 166.1 30.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.699 1.199 . . . . 0.0 112.398 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.1 t -96.19 133.56 40.36 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.673 1.189 . . . . 0.0 112.437 172.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -133.16 170.71 15.02 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.471 2.308 . . . . 0.0 109.05 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -126.54 154.42 43.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.2 m -146.71 152.39 44.74 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 126.615 1.966 . . . . 0.0 111.757 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.65 146.07 97.08 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 122.784 2.323 . . . . 0.0 113.769 176.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.351 0 C-N-CA 125.545 1.538 . . . . 0.0 111.57 169.768 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -81.58 55.53 2.69 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.515 1.926 . . . . 0.0 110.779 176.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -42.25 -43.57 3.48 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.157 2.183 . . . . 0.0 115.206 -169.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -66.51 -39.47 88.68 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 121.637 2.017 . . . . 0.0 113.869 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -59.09 -38.62 79.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.485 1.514 . . . . 0.0 111.395 170.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 57.9 m -67.24 -48.54 67.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.307 0.643 . . . . 0.0 112.447 172.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.53 -39.22 90.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.129 0.972 . . . . 0.0 112.382 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -74.26 -33.74 63.38 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.936 0.789 . . . . 0.0 112.241 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -63.23 -39.48 94.73 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.405 -0.809 . . . . 0.0 111.39 171.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -70.54 -41.56 72.36 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.768 -0.582 . . . . 0.0 111.792 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -57.0 -41.47 78.53 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.393 0.997 . . . . 0.0 111.022 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.1 m -62.25 -27.41 68.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.331 1.052 . . . . 0.0 113.775 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 tp -86.22 -43.82 12.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.653 1.981 . . . . 0.0 110.422 173.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 150.4 4.67 0.21 Allowed Glycine 0 CA--C 1.534 1.243 0 CA-C-O 117.187 -1.896 . . . . 0.0 117.243 169.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -144.37 177.84 8.35 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.925 2.362 . . . . 0.0 114.516 -168.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.32 159.09 32.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.168 0.987 . . . . 0.0 112.713 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.7 155.5 16.27 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.491 1.044 . . . . 0.0 113.579 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -145.61 150.69 36.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.907 1.683 . . . . 0.0 111.818 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.5 m -77.97 154.15 31.82 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.717 -0.615 . . . . 0.0 111.034 168.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.1 mm -113.33 -37.91 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.982 1.713 . . . . 0.0 110.171 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.77 -111.27 0.39 Allowed Glycine 0 N--CA 1.463 0.47 0 N-CA-C 108.686 -1.765 . . . . 0.0 108.686 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.74 2.73 9.34 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.956 0.902 . . . . 0.0 113.364 168.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -136.52 158.74 43.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.352 2.261 . . . . 0.0 110.425 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.1 p -130.19 152.27 49.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.448 1.499 . . . . 0.0 112.276 173.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -137.91 167.77 21.08 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.53 1.532 . . . . 0.0 112.53 -174.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -109.22 148.76 30.43 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.9 m -144.4 152.64 54.11 Favored Pre-proline 0 N--CA 1.48 1.038 0 C-N-CA 125.636 1.574 . . . . 0.0 113.018 -172.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -61.48 158.7 35.05 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.899 3.066 . . . . 0.0 116.153 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.472 0 C-N-CA 127.163 2.185 . . . . 0.0 115.14 176.838 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 118.543 2.794 . . . . 0.0 118.543 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 57.11 32.64 22.03 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-N 119.759 1.163 . . . . 0.0 111.748 -166.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.62 -37.27 79.62 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.926 1.69 . . . . 0.0 112.768 -173.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -43.24 78.75 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.514 1.052 . . . . 0.0 110.013 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 54.5 mtt85 -69.89 -36.74 75.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.57 1.548 . . . . 0.0 112.449 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.2 t -65.43 -53.02 49.0 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.533 0.683 . . . . 0.0 111.128 173.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -23.63 59.32 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.031 -1.043 . . . . 0.0 113.365 -172.055 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.1 tp -59.04 -46.97 86.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.965 1.706 . . . . 0.0 110.905 168.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 t -61.3 -34.24 74.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.684 0.793 . . . . 0.0 111.751 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.98 -41.91 58.6 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.79 1.236 . . . . 0.0 112.657 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -63.79 -31.04 72.09 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.198 1.399 . . . . 0.0 112.158 175.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.0 m -62.81 -4.68 2.24 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.775 1.23 . . . . 0.0 113.647 167.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -122.38 -4.1 8.88 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.175 2.19 . . . . 0.0 112.854 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.43 -6.43 71.33 Favored Glycine 0 CA--C 1.542 1.746 0 C-N-CA 126.777 2.132 . . . . 0.0 116.242 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.83 157.1 35.58 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.912 2.085 . . . . 0.0 112.922 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.1 mt -110.81 151.82 27.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.507 1.523 . . . . 0.0 109.623 169.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.33 157.06 17.0 Favored Glycine 0 N--CA 1.476 1.327 0 CA-C-N 119.349 0.977 . . . . 0.0 114.508 -178.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -146.74 144.74 29.62 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.855 1.662 . . . . 0.0 112.374 173.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.76 122.95 26.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.103 0.561 . . . . 0.0 110.879 171.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.9 mm -81.16 -22.6 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.586 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.48 -68.16 0.5 Allowed Glycine 0 CA--C 1.524 0.651 0 C-N-CA 126.637 2.065 . . . . 0.0 110.685 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -87.58 -19.42 27.84 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.052 1.741 . . . . 0.0 113.083 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -137.17 162.2 34.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.558 1.943 . . . . 0.0 111.425 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.12 151.24 21.19 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.033 1.333 . . . . 0.0 110.046 168.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -138.63 146.86 42.21 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.333 1.053 . . . . 0.0 110.706 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -115.38 154.97 28.24 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.51 1.124 . . . . 0.0 113.221 173.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.6 m -143.46 155.88 60.59 Favored Pre-proline 0 N--CA 1.471 0.603 0 C-N-CA 126.654 1.982 . . . . 0.0 110.775 -173.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -66.09 156.63 63.73 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.551 2.167 . . . . 0.0 113.289 173.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.218 0 C-N-CA 125.218 1.407 . . . . 0.0 113.199 179.774 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.7 p . . . . . 0 CA--C 1.549 0.942 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.255 4.5 m-80 57.94 23.65 10.1 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.479 2.312 . . . . 0.0 115.907 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -50.93 -37.02 41.63 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.287 1.035 . . . . 0.0 112.708 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -58.22 -33.22 69.08 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -175.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -97.73 -30.24 12.92 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.476 1.035 . . . . 0.0 112.492 172.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -57.01 -48.08 79.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.103 0.961 . . . . 0.0 112.288 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -53.83 -42.11 68.12 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.309 1.044 . . . . 0.0 112.319 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.54 -44.68 70.46 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.248 2.219 . . . . 0.0 111.445 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 t -71.26 -34.7 70.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.783 1.233 . . . . 0.0 112.617 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 57.6 m -71.59 -27.44 63.13 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.487 -0.758 . . . . 0.0 111.608 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -56.64 -31.83 64.73 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.618 1.167 . . . . 0.0 112.212 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.8 t -62.28 -22.58 66.12 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.82 1.248 . . . . 0.0 113.878 174.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.2 mt -105.65 -7.35 18.54 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.934 1.694 . . . . 0.0 113.124 173.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.0 21.35 25.78 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.516 1.531 . . . . 0.0 116.171 173.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.9 167.21 22.52 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.008 1.404 . . . . 0.0 113.278 -177.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.6 mt -79.33 167.59 20.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.453 1.501 . . . . 0.0 112.178 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.51 137.29 14.14 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.859 1.218 . . . . 0.0 111.969 169.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -132.72 138.01 47.09 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.353 1.461 . . . . 0.0 110.735 176.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 89.5 m -70.49 124.88 25.28 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 171.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -110.51 78.68 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 127.37 2.268 . . . . 0.0 106.805 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.42 -124.38 7.18 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 125.932 1.73 . . . . 0.0 112.415 -172.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -74.57 3.18 8.13 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.498 2.319 . . . . 0.0 114.788 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -151.15 136.25 17.5 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.523 1.129 . . . . 0.0 111.674 -166.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -95.24 138.59 32.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.538 0.735 . . . . 0.0 112.711 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -132.19 156.28 46.72 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.494 2.318 . . . . 0.0 110.644 -177.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.4 m -82.67 137.28 34.51 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.591 -0.693 . . . . 0.0 112.399 -175.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 m -136.38 145.27 51.05 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 125.132 1.373 . . . . 0.0 112.776 -173.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.66 151.49 83.34 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.248 2.632 . . . . 0.0 113.752 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.134 1.374 . . . . 0.0 113.752 174.908 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.7 m . . . . . 0 CA--C 1.536 0.439 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -83.82 55.05 3.1 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.615 1.166 . . . . 0.0 108.879 170.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 19.3 tp -52.45 -33.1 42.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.703 1.601 . . . . 0.0 115.169 -168.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 66.1 ttp85 -62.73 -48.97 76.9 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.768 1.622 . . . . 0.0 112.571 173.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -65.87 -29.6 70.08 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.603 0.761 . . . . 0.0 112.198 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.5 m -68.84 -51.09 44.29 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.672 0.789 . . . . 0.0 110.88 169.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -60.06 -43.3 95.53 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.165 0.986 . . . . 0.0 112.301 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 pp -69.55 -34.66 74.51 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.003 0.82 . . . . 0.0 111.989 -178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -63.73 -47.35 81.42 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.873 0.869 . . . . 0.0 111.1 171.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.79 -37.23 62.43 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 118.118 0.417 . . . . 0.0 112.089 -176.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -61.33 -33.71 74.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.802 1.241 . . . . 0.0 111.738 173.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 m -67.65 -2.45 6.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 171.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.0 mt -124.08 9.96 8.73 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.268 2.227 . . . . 0.0 112.476 172.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.64 -4.86 62.95 Favored Glycine 0 CA--C 1.541 1.689 0 N-CA-C 116.159 1.224 . . . . 0.0 116.159 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.16 171.12 11.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.347 2.259 . . . . 0.0 113.174 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -123.53 137.05 54.85 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.338 1.855 . . . . 0.0 108.738 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.13 136.31 13.47 Favored Glycine 0 N--CA 1.468 0.82 0 C-N-CA 125.534 1.54 . . . . 0.0 114.583 -176.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -134.42 140.93 46.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.493 1.917 . . . . 0.0 110.881 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.5 t -76.37 140.17 41.29 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.195 -0.941 . . . . 0.0 111.728 169.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.8 mt -85.02 -58.27 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.127 0.971 . . . . 0.0 109.729 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -168.09 -49.37 0.03 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.863 1.697 . . . . 0.0 112.073 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.82 -11.94 6.57 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.623 1.569 . . . . 0.0 113.753 170.165 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -115.63 149.38 38.4 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.853 1.661 . . . . 0.0 113.181 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.1 m -83.93 147.9 27.23 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.416 1.086 . . . . 0.0 111.951 167.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -131.4 130.09 42.14 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.587 1.955 . . . . 0.0 109.245 170.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.6 m -119.71 136.99 54.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.272 0.629 . . . . 0.0 112.359 177.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -137.95 161.99 56.66 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.846 1.658 . . . . 0.0 110.379 -173.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.83 156.75 41.65 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.388 2.059 . . . . 0.0 113.052 172.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.32 175.329 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -78.49 40.42 0.37 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.338 1.455 . . . . 0.0 111.211 169.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 15.3 tp -57.15 -31.61 65.54 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.117 1.367 . . . . 0.0 114.331 -167.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -58.85 -35.44 72.93 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.466 1.106 . . . . 0.0 113.124 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -81.79 -35.93 28.98 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.14 1.376 . . . . 0.0 111.642 173.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -61.86 -45.78 92.32 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.164 0.586 . . . . 0.0 112.063 178.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -56.57 -45.91 81.04 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.853 -0.529 . . . . 0.0 111.856 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -70.08 -39.25 75.71 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.868 2.067 . . . . 0.0 111.591 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.3 m -60.44 -46.19 90.95 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.247 1.019 . . . . 0.0 110.868 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.5 m -78.0 -29.66 49.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.527 0.731 . . . . 0.0 112.216 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.66 -38.26 89.63 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 120.375 -1.453 . . . . 0.0 111.255 170.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.5 m -70.01 -14.07 62.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.771 1.229 . . . . 0.0 114.103 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -103.26 -14.95 16.13 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.082 1.353 . . . . 0.0 113.159 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.18 37.28 6.32 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.471 1.51 . . . . 0.0 115.286 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -150.94 163.6 38.31 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 118.976 1.388 . . . . 0.0 113.301 175.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.0 mp -90.6 158.43 16.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.269 1.828 . . . . 0.0 111.883 -172.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.87 154.25 16.47 Favored Glycine 0 N--CA 1.478 1.49 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -151.16 140.22 21.11 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.129 1.772 . . . . 0.0 113.244 173.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.8 t -75.51 138.84 41.82 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 120.787 -1.196 . . . . 0.0 111.992 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.3 mt -142.25 103.33 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 122.33 1.062 . . . . 0.0 112.074 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 -60.16 2.84 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 127.942 2.687 . . . . 0.0 114.582 168.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.26 5.6 0.64 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -159.7 154.62 24.68 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.073 0.851 . . . . 0.0 110.968 -178.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.98 146.64 27.89 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.292 -0.88 . . . . 0.0 112.695 177.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -128.63 158.41 38.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.7 1.6 . . . . 0.0 109.86 171.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 88.2 m -119.16 153.71 34.45 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.734 0.778 . . . . 0.0 112.63 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 m -140.73 151.48 63.23 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 126.287 1.835 . . . . 0.0 111.837 -168.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -65.44 155.98 65.89 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.902 2.401 . . . . 0.0 116.648 -168.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.385 0 C-N-CA 126.824 2.05 . . . . 0.0 114.298 174.919 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.9 t . . . . . 0 CA--C 1.537 0.475 0 CA-C-O 121.38 0.609 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -71.58 34.75 0.06 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.302 1.841 . . . . 0.0 112.524 169.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -49.16 -46.7 45.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.686 1.994 . . . . 0.0 113.737 -167.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -67.9 -37.38 81.65 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -64.25 -42.57 96.45 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.312 1.445 . . . . 0.0 110.988 169.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.0 m -66.03 -43.14 88.49 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.221 0.608 . . . . 0.0 111.888 179.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -62.78 -35.41 79.75 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.884 -1.135 . . . . 0.0 112.58 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 tp -69.67 -37.54 76.73 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.791 1.636 . . . . 0.0 111.027 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.4 t -65.25 -44.51 87.9 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.074 -1.016 . . . . 0.0 111.33 173.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.9 m -70.65 -26.59 63.53 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.143 -0.973 . . . . 0.0 112.222 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -60.63 -24.71 65.75 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.043 -1.036 . . . . 0.0 112.396 170.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.3 p -63.38 -38.9 92.92 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.466 1.03 . . . . 0.0 112.848 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.4 mt -98.39 12.5 34.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.377 1.471 . . . . 0.0 113.045 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.49 22.11 56.99 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.725 1.45 . . . . 0.0 116.725 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.11 -174.56 3.58 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.211 1.506 . . . . 0.0 113.844 -175.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -97.76 156.45 16.56 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.673 1.589 . . . . 0.0 111.905 -174.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.04 150.67 17.14 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 124.723 1.154 . . . . 0.0 114.329 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -137.93 149.47 46.21 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.016 2.126 . . . . 0.0 112.159 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.2 m -91.05 145.5 24.64 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.789 1.236 . . . . 0.0 112.632 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.7 mm -139.83 74.78 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.573 1.549 . . . . 0.0 108.715 169.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.02 -120.06 8.39 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.225 1.393 . . . . 0.0 112.974 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -75.09 -5.53 44.71 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.474 -1.015 . . . . 0.0 113.425 172.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -120.13 177.9 4.83 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.894 1.678 . . . . 0.0 111.717 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 30.1 m -136.09 162.47 32.81 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 125.073 1.349 . . . . 0.0 112.591 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -136.01 175.73 9.33 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.357 2.263 . . . . 0.0 110.767 171.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.4 m -116.14 164.38 14.56 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.581 0.752 . . . . 0.0 110.59 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -142.12 149.21 51.37 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.947 1.699 . . . . 0.0 110.348 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.1 139.58 85.54 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.688 2.259 . . . . 0.0 112.018 177.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.293 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -176.643 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.2 t . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -81.02 54.3 2.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.574 1.549 . . . . 0.0 110.985 168.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.4 tt -47.83 -39.22 17.79 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.939 2.096 . . . . 0.0 112.891 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -59.81 -40.27 87.82 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.705 1.202 . . . . 0.0 113.573 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -71.0 -36.39 72.45 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.078 1.751 . . . . 0.0 111.657 172.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.4 m -66.33 -43.28 86.6 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.191 0.905 . . . . 0.0 112.8 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 49.4 mt-10 -62.26 -38.47 89.4 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.035 -1.04 . . . . 0.0 112.547 176.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.5 -42.51 87.27 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.02 1.728 . . . . 0.0 110.347 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -59.84 -47.91 83.84 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.361 1.065 . . . . 0.0 111.592 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.0 m -74.04 -21.16 60.06 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.958 -1.089 . . . . 0.0 112.931 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -61.76 -22.05 65.07 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.921 -1.112 . . . . 0.0 112.549 169.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 p -74.55 -28.4 60.93 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 170.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.2 mt -90.84 -15.72 29.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.675 1.99 . . . . 0.0 113.319 177.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.13 18.11 11.77 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.527 1.537 . . . . 0.0 116.053 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -155.12 -178.12 7.02 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 119.743 1.772 . . . . 0.0 113.26 -173.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.58 167.19 21.63 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.219 1.408 . . . . 0.0 111.264 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.405 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -142.98 146.04 16.5 Favored Glycine 0 N--CA 1.473 1.145 0 O-C-N 121.029 -1.044 . . . . 0.0 114.915 -174.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -147.24 152.6 38.59 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.962 2.105 . . . . 0.0 110.393 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.8 m -77.74 131.8 37.83 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.123 -0.986 . . . . 0.0 112.301 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.8 mm -130.18 87.1 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-O 122.866 1.317 . . . . 0.0 108.674 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.13 -143.79 31.26 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 113.85 -1.523 . . . . 0.0 112.383 -170.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -74.83 21.74 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -155.83 149.36 24.92 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.665 -1.272 . . . . 0.0 112.304 -175.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.7 m -79.95 135.26 36.36 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 113.297 175.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -117.77 158.96 23.83 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.655 1.982 . . . . 0.0 110.032 167.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.4 m -113.87 149.03 35.68 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -169.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.8 m -135.11 153.06 78.1 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 125.794 1.637 . . . . 0.0 112.041 -170.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -67.77 151.11 79.08 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.813 2.342 . . . . 0.0 115.683 -169.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.607 1.563 . . . . 0.0 113.882 171.501 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.3 t . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -81.28 49.76 1.33 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.549 1.939 . . . . 0.0 112.036 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.4 tp -61.81 -40.77 96.41 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -172.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -66.48 -33.43 75.67 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.1 1.318 . . . . 0.0 112.061 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -73.64 -38.64 64.95 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.908 0.883 . . . . 0.0 112.224 168.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -59.17 -42.22 90.29 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.024 0.829 . . . . 0.0 111.563 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.38 -47.52 78.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.168 0.987 . . . . 0.0 112.632 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.3 tp -73.06 -29.99 63.37 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.862 1.665 . . . . 0.0 112.119 -177.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.0 t -63.94 -36.87 85.37 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.433 1.093 . . . . 0.0 111.649 169.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.47 -30.93 33.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.273 -0.892 . . . . 0.0 113.008 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -52.26 -36.63 53.15 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.003 0.921 . . . . 0.0 111.57 169.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 p -57.44 -28.63 63.5 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.4 mt -104.38 5.47 34.4 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.56 1.944 . . . . 0.0 113.698 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.14 12.42 67.98 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.57 178.24 7.15 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.594 1.697 . . . . 0.0 112.608 -177.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.0 mt -83.03 160.33 21.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.588 1.155 . . . . 0.0 111.906 -176.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.9 153.0 17.57 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 123.83 0.729 . . . . 0.0 112.672 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -149.88 132.07 15.44 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.87 0.868 . . . . 0.0 111.679 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.5 t -86.18 124.77 32.95 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.79 0.436 . . . . 0.0 110.611 169.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.19 33.82 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.811 1.644 . . . . 0.0 110.553 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.34 -64.5 1.36 Allowed Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.769 1.652 . . . . 0.0 113.317 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -74.83 -33.87 62.23 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.276 1.43 . . . . 0.0 113.504 -176.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -158.79 155.3 27.66 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.466 1.106 . . . . 0.0 112.593 -168.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -83.69 143.93 29.72 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.604 1.162 . . . . 0.0 111.355 169.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -151.09 161.08 43.4 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.185 1.394 . . . . 0.0 111.959 167.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 m -94.7 150.42 20.24 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -141.97 148.48 48.98 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 125.774 1.63 . . . . 0.0 111.136 -173.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -65.61 138.07 52.79 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.203 2.602 . . . . 0.0 113.965 -172.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.073 1.749 . . . . 0.0 113.746 179.561 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.7 p . . . . . 0 CA--C 1.543 0.704 0 CA-C-O 122.278 1.037 . . . . 0.0 113.485 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -79.1 49.85 0.99 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 128.312 2.645 . . . . 0.0 111.612 177.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -47.48 -37.82 12.58 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.972 1.309 . . . . 0.0 113.445 -170.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -57.46 -45.06 85.19 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.175 0.99 . . . . 0.0 113.63 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.13 -37.26 66.72 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.173 1.789 . . . . 0.0 110.889 173.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 64.2 m -60.48 -43.37 97.05 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.413 0.685 . . . . 0.0 112.826 175.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -56.27 -47.04 79.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.534 1.061 . . . . 0.0 110.947 172.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tp -63.21 -39.53 94.88 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.566 1.546 . . . . 0.0 111.503 177.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 m -63.06 -37.82 88.73 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.503 1.521 . . . . 0.0 113.186 171.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 64.5 m -78.08 -34.92 49.98 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.627 -0.671 . . . . 0.0 111.904 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -30.53 71.36 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.857 -1.152 . . . . 0.0 111.762 176.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.7 t -63.24 -41.64 99.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 0.0 111.676 168.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.15 -6.41 54.69 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.151 1.38 . . . . 0.0 113.662 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.54 13.15 56.09 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 125.981 1.753 . . . . 0.0 115.79 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -141.63 171.86 13.48 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.898 1.349 . . . . 0.0 113.404 -175.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.4 mt -75.07 151.09 38.69 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 112.289 -173.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.34 136.88 12.94 Favored Glycine 0 N--CA 1.471 0.98 0 O-C-N 121.409 -0.807 . . . . 0.0 112.864 173.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -143.55 166.93 23.46 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.848 1.659 . . . . 0.0 110.874 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 t -150.07 153.43 36.42 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -173.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -129.48 103.07 8.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 126.349 1.859 . . . . 0.0 107.53 167.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.03 -102.3 0.34 Allowed Glycine 0 CA--C 1.534 1.278 0 C-N-CA 127.087 2.28 . . . . 0.0 114.533 176.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.03 10.48 28.88 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.816 2.047 . . . . 0.0 113.034 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -143.15 115.6 8.55 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.138 -1.601 . . . . 0.0 113.677 -173.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.2 m -84.6 138.91 32.45 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.66 1.584 . . . . 0.0 112.311 169.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.17 135.88 26.0 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.354 1.462 . . . . 0.0 110.495 169.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 m -78.32 153.43 31.73 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.9 m -141.82 148.95 51.43 Favored Pre-proline 0 N--CA 1.478 0.942 0 C-N-CA 124.856 1.263 . . . . 0.0 112.054 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_exo -67.67 161.74 42.38 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.658 2.239 . . . . 0.0 112.961 170.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.258 1.533 0 C-N-CA 124.748 1.219 . . . . 0.0 112.765 174.179 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.8 p . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.9 m120 51.73 32.92 10.12 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 127.511 2.324 . . . . 0.0 114.897 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.7 -31.0 24.3 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 -168.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -59.02 -40.19 84.24 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.12 1.327 . . . . 0.0 112.245 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 mmm180 -70.34 -39.78 74.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.469 1.107 . . . . 0.0 111.569 174.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.3 m -67.62 -43.7 79.77 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.269 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.42 -34.72 78.85 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.196 -0.94 . . . . 0.0 113.194 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tp -66.93 -36.69 82.8 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 110.393 171.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.9 m -66.88 -42.44 85.56 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.463 -0.773 . . . . 0.0 111.397 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.96 -36.86 75.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.879 0.763 . . . . 0.0 111.669 175.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -54.65 -40.71 69.28 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.995 -1.065 . . . . 0.0 111.163 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.1 m -75.01 3.27 8.66 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.885 1.674 . . . . 0.0 114.693 176.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -123.9 2.47 8.74 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.008 2.123 . . . . 0.0 112.271 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.35 19.53 66.41 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 125.387 1.47 . . . . 0.0 115.884 177.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -139.9 173.32 11.64 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.81 1.805 . . . . 0.0 112.747 -177.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.6 mt -86.58 176.74 7.65 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.164 1.386 . . . . 0.0 111.553 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -154.46 153.92 25.15 Favored Glycine 0 N--CA 1.474 1.171 0 O-C-N 120.902 -1.124 . . . . 0.0 115.128 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -141.32 147.43 38.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.446 1.498 . . . . 0.0 112.226 -174.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.1 t -81.64 133.85 35.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.747 0.819 . . . . 0.0 112.178 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.0 mt -122.32 65.08 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 127.075 2.15 . . . . 0.0 108.877 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.95 -69.73 0.78 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 127.209 2.337 . . . . 0.0 115.016 176.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -100.74 -18.03 16.67 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.031 1.332 . . . . 0.0 112.954 -174.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -146.52 176.32 9.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 126.371 1.868 . . . . 0.0 112.143 -169.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 29.6 p -126.82 142.68 51.48 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.896 1.278 . . . . 0.0 111.396 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -135.6 150.73 49.76 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.151 0.98 . . . . 0.0 111.853 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 m -79.55 155.03 28.38 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 169.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -143.51 151.0 53.1 Favored Pre-proline 0 N--CA 1.476 0.852 0 C-N-CA 126.206 1.803 . . . . 0.0 111.039 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -59.2 146.7 93.68 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.192 2.595 . . . . 0.0 114.954 -173.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.966 1.706 . . . . 0.0 112.487 173.41 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.42 45.53 0.67 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.54 1.536 . . . . 0.0 111.14 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.48 -38.49 44.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.463 2.305 . . . . 0.0 113.063 -168.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -64.31 -35.35 80.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.313 -0.867 . . . . 0.0 112.773 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -85.56 -32.15 22.29 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.359 1.464 . . . . 0.0 113.545 171.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -68.46 -35.46 77.59 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.089 0.859 . . . . 0.0 112.354 176.286 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.23 -36.47 66.05 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.194 -1.566 . . . . 0.0 111.954 169.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.4 tp -82.05 -37.78 25.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.06 1.744 . . . . 0.0 111.37 -177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 83.6 p -65.0 -41.81 95.06 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.474 1.033 . . . . 0.0 111.179 175.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.25 -41.92 84.81 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.008 -0.432 . . . . 0.0 110.425 174.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -61.86 -33.35 74.03 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.811 -1.181 . . . . 0.0 112.402 176.29 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 41.7 t -66.4 -29.35 69.48 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.064 0.946 . . . . 0.0 112.658 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.79 -48.04 17.51 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.92 -1.112 . . . . 0.0 111.126 170.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 144.65 15.71 0.22 Allowed Glycine 0 CA--C 1.537 1.453 0 CA-C-O 117.82 -1.544 . . . . 0.0 116.098 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.94 179.53 7.41 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 120.202 2.001 . . . . 0.0 113.132 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.3 mt -88.46 160.05 17.7 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.851 -1.155 . . . . 0.0 112.844 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.26 138.7 15.14 Favored Glycine 0 N--CA 1.469 0.881 0 C-N-CA 124.295 0.95 . . . . 0.0 113.801 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -141.7 171.25 14.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.354 2.261 . . . . 0.0 109.826 172.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.0 t -150.06 139.01 20.99 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 -174.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.8 mm -117.91 115.41 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.468 1.907 . . . . 0.0 110.57 -174.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -87.03 0.18 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 126.139 1.828 . . . . 0.0 111.676 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 50.0 mp0 -129.42 5.23 5.18 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.17 1.788 . . . . 0.0 112.71 172.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -115.77 117.17 29.49 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.169 0.988 . . . . 0.0 113.163 -168.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.0 m -74.36 138.98 43.78 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 120.569 -1.332 . . . . 0.0 113.153 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -147.13 127.22 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.793 1.637 . . . . 0.0 111.285 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.8 m -77.65 147.69 35.42 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -130.18 148.29 69.15 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 126.532 1.933 . . . . 0.0 110.64 -175.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -65.26 145.29 83.51 Favored 'Trans proline' 0 C--O 1.239 0.547 0 C-N-CA 122.44 2.094 . . . . 0.0 112.901 -171.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 C-N-CA 125.493 1.517 . . . . 0.0 111.158 177.138 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.5 t . . . . . 0 CA--C 1.552 1.035 0 CA-C-O 121.065 0.46 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -111.65 66.5 0.63 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.196 1.798 . . . . 0.0 111.401 -168.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.56 -42.08 15.32 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.207 1.803 . . . . 0.0 114.073 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -65.43 -34.04 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 120.24 -1.538 . . . . 0.0 113.519 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -73.1 -38.14 66.48 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.955 0.902 . . . . 0.0 111.29 172.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.7 t -62.65 -40.84 98.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.473 1.109 . . . . 0.0 112.098 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -58.25 -41.54 84.46 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.864 1.265 . . . . 0.0 112.446 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.2 tp -69.71 -42.71 73.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.377 0.989 . . . . 0.0 110.125 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.9 t -57.82 -39.02 76.62 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.788 -0.57 . . . . 0.0 112.485 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.4 m -79.67 -32.92 41.55 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.474 -0.766 . . . . 0.0 112.975 175.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -60.49 -29.65 69.21 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.644 -1.285 . . . . 0.0 112.539 170.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.6 p -67.64 -14.47 62.97 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 172.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -103.24 -24.71 13.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.151 1.78 . . . . 0.0 112.502 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.01 2.14 28.38 Favored Glycine 0 CA--C 1.542 1.759 0 C-N-CA 125.905 1.717 . . . . 0.0 116.076 174.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.449 ' H ' HD23 ' A' ' 17' ' ' LEU . 1.8 pt? -121.24 171.96 8.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.983 1.713 . . . . 0.0 112.347 -178.024 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -73.74 154.31 39.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.952 1.301 . . . . 0.0 112.117 -173.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.95 141.89 15.61 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 123.933 0.778 . . . . 0.0 113.938 175.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -138.2 153.39 49.16 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.602 1.561 . . . . 0.0 111.729 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 m -100.19 95.28 6.71 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.247 1.419 . . . . 0.0 110.183 172.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -82.86 68.65 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-O 123.204 1.478 . . . . 0.0 110.146 -176.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.84 -92.33 0.19 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 127.083 2.278 . . . . 0.0 111.879 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -66.78 -28.61 68.53 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 -177.007 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -155.96 168.06 28.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.75 1.613 . . . . 0.0 114.739 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 t -70.92 132.8 45.77 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.932 0.893 . . . . 0.0 112.712 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -140.07 139.24 35.86 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.15 1.38 . . . . 0.0 110.12 168.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.6 m -87.19 152.69 22.1 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.825 -0.547 . . . . 0.0 112.24 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -138.79 151.8 69.25 Favored Pre-proline 0 N--CA 1.48 1.03 0 C-N-CA 125.088 1.355 . . . . 0.0 111.848 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -65.23 130.5 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 122.713 2.275 . . . . 0.0 111.293 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.404 0 C-N-CA 124.807 1.243 . . . . 0.0 113.417 -174.635 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.3 p . . . . . 0 CA--C 1.551 0.982 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -84.93 44.2 1.05 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.543 1.937 . . . . 0.0 112.754 -176.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.97 -39.61 90.52 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.36 1.464 . . . . 0.0 113.062 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -44.51 68.91 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.244 1.418 . . . . 0.0 110.865 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -69.28 -38.06 78.18 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.978 1.711 . . . . 0.0 112.97 172.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.75 -41.43 97.66 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.502 0.592 . . . . 0.0 112.478 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -63.06 -34.74 78.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.22 -0.925 . . . . 0.0 112.288 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -45.29 65.49 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.738 2.415 . . . . 0.0 110.839 174.496 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.0 t -58.4 -48.95 79.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.568 1.147 . . . . 0.0 111.509 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -70.88 -31.94 68.75 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.381 -0.824 . . . . 0.0 111.871 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -60.89 -24.79 66.24 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.618 -1.301 . . . . 0.0 113.244 169.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 p -61.84 -28.91 69.82 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.279 1.399 . . . . 0.0 112.326 173.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.06 -2.5 27.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.222 2.209 . . . . 0.0 113.404 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.63 30.83 20.32 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 174.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.5 171.87 13.46 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 119.812 1.806 . . . . 0.0 113.73 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.3 mt -79.25 170.96 15.85 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.977 1.711 . . . . 0.0 112.291 -175.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.99 146.58 17.94 Favored Glycine 0 CA--C 1.537 1.411 0 N-CA-C 115.401 0.92 . . . . 0.0 115.401 -175.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -140.6 156.33 46.31 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.593 2.357 . . . . 0.0 111.508 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.1 p -110.05 55.4 0.64 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.108 1.363 . . . . 0.0 112.512 174.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.9 mm -55.49 -47.6 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.297 1.439 . . . . 0.0 113.446 -168.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -107.9 41.66 2.15 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.652 1.596 . . . . 0.0 112.257 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 64.21 -33.4 0.14 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 127.37 2.268 . . . . 0.0 114.837 -169.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -79.59 150.78 30.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.951 1.701 . . . . 0.0 112.096 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -65.16 131.68 47.17 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -176.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -129.14 128.5 43.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.255 2.222 . . . . 0.0 109.099 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 27.9 m -85.1 147.52 26.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 174.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.3 m -137.07 149.3 65.88 Favored Pre-proline 0 N--CA 1.479 1.011 0 C-N-CA 124.912 1.285 . . . . 0.0 112.107 -170.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.04 137.72 38.29 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 123.297 2.665 . . . . 0.0 114.404 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 C-N-CA 126.574 1.95 . . . . 0.0 113.114 -178.971 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.3 m . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.41 36.62 0.43 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.507 1.923 . . . . 0.0 112.492 174.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mt -55.87 -48.01 76.34 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.021 1.328 . . . . 0.0 113.453 -170.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.7 ttp85 -63.8 -34.81 78.74 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.656 -1.278 . . . . 0.0 111.341 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -72.08 -34.31 68.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 126.883 2.073 . . . . 0.0 113.906 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.91 -40.38 28.35 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.782 0.719 . . . . 0.0 112.127 175.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -53.39 -35.07 59.96 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.63 1.572 . . . . 0.0 112.974 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.32 -31.6 72.49 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.591 1.087 . . . . 0.0 112.994 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.0 t -77.6 -39.33 45.9 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.409 1.084 . . . . 0.0 111.07 171.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.9 m -66.3 -38.64 88.22 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.084 -1.01 . . . . 0.0 111.372 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -43.48 89.82 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.52 1.128 . . . . 0.0 111.196 170.235 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -59.3 -32.89 70.46 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.484 0.714 . . . . 0.0 112.872 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 97.0 mt -91.17 -4.8 55.8 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.006 1.722 . . . . 0.0 113.632 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 29.88 57.74 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.711 1.624 . . . . 0.0 115.907 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.31 178.43 7.42 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 118.42 1.11 . . . . 0.0 112.489 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -91.58 147.62 22.87 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.975 -1.078 . . . . 0.0 112.415 -169.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -88.77 137.39 14.22 Favored Glycine 0 CA--C 1.533 1.167 0 O-C-N 121.462 -0.773 . . . . 0.0 112.368 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -145.26 137.02 25.47 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.701 1.2 . . . . 0.0 111.023 176.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -81.67 73.68 8.7 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.415 -0.803 . . . . 0.0 110.901 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 pt -64.12 -17.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -170.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.17 115.84 0.34 Allowed Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.458 1.028 . . . . 0.0 111.908 169.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 61.99 -35.74 0.11 Allowed 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 128.951 2.9 . . . . 0.0 115.889 -172.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -139.17 158.01 44.93 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 127.556 2.342 . . . . 0.0 110.644 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -87.21 140.79 29.19 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.033 1.123 . . . . 0.0 114.033 -178.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -134.44 156.67 48.15 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.996 1.719 . . . . 0.0 108.982 168.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 5.6 m -85.05 144.71 28.08 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.054 -0.404 . . . . 0.0 111.436 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.7 m -135.93 148.19 64.02 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 125.81 1.644 . . . . 0.0 111.016 -173.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.16 151.67 72.48 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.661 2.241 . . . . 0.0 111.382 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.337 0 C-N-CA 125.19 1.396 . . . . 0.0 112.073 174.989 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.3 t . . . . . 0 CA--C 1.549 0.923 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 m120 56.65 47.51 18.24 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.415 2.286 . . . . 0.0 111.654 -169.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.0 tt -53.86 -34.64 59.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.461 1.504 . . . . 0.0 113.193 -174.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.8 ttp180 -69.06 -32.85 72.61 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.762 0.825 . . . . 0.0 112.287 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -69.64 -43.69 72.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.655 1.182 . . . . 0.0 110.432 170.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -58.34 -49.26 77.85 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.864 176.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.11 -41.92 84.62 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.889 0.876 . . . . 0.0 113.191 174.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.72 -39.88 95.39 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.953 1.301 . . . . 0.0 110.802 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 p -59.88 -36.73 77.55 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.605 -0.684 . . . . 0.0 112.253 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.4 m -85.6 -37.01 20.01 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.99 0.916 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -56.8 -39.61 74.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.883 1.673 . . . . 0.0 112.067 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 m -62.36 -23.15 66.64 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.186 0.994 . . . . 0.0 113.108 175.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.7 mt -103.79 7.05 37.08 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 127.649 2.38 . . . . 0.0 113.714 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.5 23.07 61.14 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 125.099 1.333 . . . . 0.0 116.287 174.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.84 176.76 9.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.749 1.775 . . . . 0.0 113.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.8 mt -91.23 151.98 20.7 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.802 0.841 . . . . 0.0 112.537 -169.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.96 142.82 16.19 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.285 0.945 . . . . 0.0 114.314 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -134.57 114.36 12.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.324 1.45 . . . . 0.0 109.321 177.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -105.88 117.43 34.02 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.229 1.012 . . . . 0.0 110.719 -171.098 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -83.06 -45.7 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 124.354 1.061 . . . . 0.0 111.142 -170.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.57 107.0 0.79 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 126.442 1.973 . . . . 0.0 109.078 -169.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 60.68 4.99 0.83 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.055 1.742 . . . . 0.0 115.606 -167.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -149.8 147.32 27.86 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.446 1.498 . . . . 0.0 112.351 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.5 t -127.27 143.76 51.18 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.387 1.875 . . . . 0.0 110.833 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -136.07 159.11 42.73 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.674 1.99 . . . . 0.0 109.739 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 m -101.31 152.4 20.74 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.1 m -133.55 144.95 54.32 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.661 1.585 . . . . 0.0 111.969 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -62.17 150.39 86.93 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.187 2.592 . . . . 0.0 113.879 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.377 0 C-N-CA 125.072 1.349 . . . . 0.0 112.075 174.369 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.9 t . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -85.27 39.56 0.78 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 -173.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -49.49 -47.28 48.68 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.455 1.502 . . . . 0.0 114.776 -171.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -66.05 -37.09 84.96 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.107 1.322 . . . . 0.0 113.608 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -74.55 -37.93 62.87 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.44 1.096 . . . . 0.0 111.729 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.1 t -63.95 -44.88 91.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.528 1.131 . . . . 0.0 111.876 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -56.38 -35.59 67.9 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.207 1.003 . . . . 0.0 113.332 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.6 tp -71.2 -34.08 70.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 110.877 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -72.43 -41.22 66.43 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.792 -1.192 . . . . 0.0 112.192 172.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.6 m -68.45 -29.71 68.42 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.023 -1.048 . . . . 0.0 111.468 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.43 -37.16 74.81 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.203 1.001 . . . . 0.0 111.381 168.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.4 p -67.49 -17.85 64.84 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.7 mt -107.72 1.66 23.19 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.18 2.192 . . . . 0.0 112.783 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.43 28.37 69.79 Favored Glycine 0 CA--C 1.539 1.578 0 O-C-N 120.82 -1.175 . . . . 0.0 115.833 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -142.41 -178.27 5.67 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 119.109 1.454 . . . . 0.0 112.723 178.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 mt -88.79 148.77 23.75 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.64 1.176 . . . . 0.0 112.083 -173.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -92.34 141.11 15.44 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.187 -0.785 . . . . 0.0 111.984 168.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -148.77 129.95 14.56 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.373 1.069 . . . . 0.0 112.982 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.7 m -84.17 118.78 24.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 112.34 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.1 mm -147.69 125.0 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.938 1.695 . . . . 0.0 109.801 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.05 47.37 13.5 Favored Glycine 0 CA--C 1.534 1.25 0 O-C-N 121.646 -0.659 . . . . 0.0 113.872 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 65.74 6.64 4.02 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.27 2.228 . . . . 0.0 116.486 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -146.2 151.66 37.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.238 1.015 . . . . 0.0 113.012 173.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -79.85 142.19 35.47 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 121.831 -0.543 . . . . 0.0 112.464 172.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -140.14 161.19 38.22 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.776 2.03 . . . . 0.0 109.673 169.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -87.78 154.03 20.88 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.766 -0.584 . . . . 0.0 112.548 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.0 m -139.85 146.2 46.03 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 126.542 1.937 . . . . 0.0 111.437 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -65.93 139.6 57.36 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.724 2.282 . . . . 0.0 112.929 -177.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.229 1.012 . . . . 0.0 111.529 171.009 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.4 m . . . . . 0 CA--C 1.546 0.799 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.2 m120 52.35 49.15 21.12 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.706 1.602 . . . . 0.0 110.873 -169.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.73 -36.11 69.35 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -168.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -60.14 -36.58 77.85 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.672 -1.268 . . . . 0.0 113.414 174.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.77 -33.42 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.969 1.308 . . . . 0.0 111.465 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 t -67.44 -47.61 69.67 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.816 0.847 . . . . 0.0 112.21 174.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -60.22 -41.23 92.62 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.824 -1.173 . . . . 0.0 112.049 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -73.69 -30.49 62.91 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.419 1.008 . . . . 0.0 112.661 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 t -60.84 -44.09 97.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -74.63 -33.25 62.52 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.793 -0.567 . . . . 0.0 112.343 176.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -62.35 -30.24 71.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.88 -1.137 . . . . 0.0 111.887 172.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 t -62.85 -33.53 75.44 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 170.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -86.72 -18.93 29.98 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.805 1.242 . . . . 0.0 113.461 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.32 15.62 10.33 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.978 1.751 . . . . 0.0 116.075 173.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -146.96 176.19 10.1 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.526 1.663 . . . . 0.0 114.537 -172.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.53 159.79 33.65 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.328 1.851 . . . . 0.0 111.914 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.61 142.3 13.62 Favored Glycine 0 N--CA 1.474 1.198 0 C-N-CA 124.126 0.87 . . . . 0.0 114.388 -178.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -146.17 160.67 41.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.593 1.557 . . . . 0.0 112.206 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -88.25 137.38 32.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.439 0.696 . . . . 0.0 112.757 171.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.2 mt -71.86 -38.8 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.208 1.803 . . . . 0.0 111.361 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.7 -49.56 0.11 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 126.973 2.225 . . . . 0.0 109.648 -176.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -131.95 -7.88 3.5 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.927 1.291 . . . . 0.0 114.479 169.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -125.59 152.36 45.23 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.062 1.345 . . . . 0.0 113.806 -176.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.1 t -76.43 136.97 39.44 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.565 1.546 . . . . 0.0 114.021 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -133.38 136.41 45.29 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.706 2.402 . . . . 0.0 109.359 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 m -94.86 147.86 22.91 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.24 148.4 51.11 Favored Pre-proline 0 N--CA 1.482 1.137 0 C-N-CA 125.378 1.471 . . . . 0.0 111.996 -176.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -74.04 154.94 47.73 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.879 2.386 . . . . 0.0 113.923 -176.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.333 0 C-N-CA 125.514 1.526 . . . . 0.0 113.037 177.594 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 37.5 t . . . . . 0 CA--C 1.545 0.771 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -74.93 32.66 0.1 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.632 1.573 . . . . 0.0 113.177 174.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.6 tt -56.08 -39.72 72.54 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.982 1.713 . . . . 0.0 112.646 -169.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -63.21 -40.95 98.93 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.233 1.013 . . . . 0.0 112.303 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -74.94 -35.66 62.13 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 118.736 0.698 . . . . 0.0 112.779 173.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.0 m -64.29 -39.93 94.92 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.284 0.493 . . . . 0.0 112.051 175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.83 -34.37 73.0 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.865 -1.147 . . . . 0.0 113.513 176.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 tp -70.74 -44.67 66.33 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.563 1.545 . . . . 0.0 110.12 176.335 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 t -63.06 -45.07 93.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.738 0.815 . . . . 0.0 112.117 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.5 m -74.28 -27.92 60.96 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.347 -0.846 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 -60.67 -37.51 81.82 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 121.133 -0.979 . . . . 0.0 111.288 167.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.9 m -67.29 -21.74 65.67 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 172.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.8 mt -97.49 -5.26 36.34 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.315 1.446 . . . . 0.0 113.208 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.57 49.02 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.923 1.249 . . . . 0.0 115.924 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.74 168.78 18.89 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 118.938 1.369 . . . . 0.0 113.226 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.9 mt -83.31 143.71 30.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.034 1.334 . . . . 0.0 111.694 -175.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.38 131.9 10.73 Favored Glycine 0 N--CA 1.469 0.834 0 O-C-N 121.537 -0.727 . . . . 0.0 113.278 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -152.98 171.07 18.91 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.792 1.637 . . . . 0.0 111.219 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 64.3 m -122.29 162.03 22.22 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.261 1.424 . . . . 0.0 113.044 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.5 mm -128.16 96.79 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.13 1.772 . . . . 0.0 106.466 168.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.68 -137.93 20.86 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -167.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -76.87 3.19 12.56 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 175.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -121.59 132.23 54.56 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -167.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.4 m -71.18 136.1 47.91 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.587 1.155 . . . . 0.0 113.374 -178.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -150.12 84.08 1.39 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 127.287 2.235 . . . . 0.0 109.886 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -61.62 154.27 25.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.5 m -140.53 156.86 69.19 Favored Pre-proline 0 N--CA 1.488 1.47 0 C-N-CA 126.113 1.765 . . . . 0.0 113.368 -170.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -60.27 147.2 94.56 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 123.803 3.002 . . . . 0.0 116.544 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.228 1.811 . . . . 0.0 113.684 173.77 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 54.26 23.99 4.7 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.885 2.074 . . . . 0.0 115.108 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.7 tp -59.33 -23.89 62.88 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.644 1.178 . . . . 0.0 113.821 -172.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -53.58 -47.24 70.3 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 120.108 1.322 . . . . 0.0 111.624 172.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -71.89 -37.29 70.16 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.017 1.327 . . . . 0.0 113.581 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.71 -46.77 80.9 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 117.946 0.339 . . . . 0.0 111.02 174.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -58.4 -50.58 73.16 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.109 1.364 . . . . 0.0 112.258 175.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.21 -34.85 77.01 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.658 1.572 . . . . 0.0 112.172 -176.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.4 m -63.06 -39.38 94.56 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.08 0.552 . . . . 0.0 111.471 173.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -81.01 -33.71 33.45 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 178.129 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -68.33 -29.7 68.51 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.326 -1.484 . . . . 0.0 111.905 176.322 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.6 m -59.38 -27.34 65.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.076 0.95 . . . . 0.0 112.133 169.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -103.31 4.9 36.98 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.508 1.923 . . . . 0.0 113.322 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.04 30.59 46.27 Favored Glycine 0 CA--C 1.538 1.492 0 N-CA-C 116.843 1.497 . . . . 0.0 116.843 174.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -138.87 157.73 45.51 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 120.207 2.004 . . . . 0.0 114.446 177.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 22.9 tp -83.97 144.54 29.08 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.234 1.813 . . . . 0.0 112.305 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.13 145.55 16.29 Favored Glycine 0 CA--C 1.537 1.435 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -137.07 118.04 14.27 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.741 2.017 . . . . 0.0 110.348 169.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 p -71.33 127.23 31.87 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.096 -1.002 . . . . 0.0 110.136 169.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.0 mm -103.4 -33.9 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.206 1.002 . . . . 0.0 111.883 -169.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.2 -110.87 0.42 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.418 1.485 . . . . 0.0 111.154 -170.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -71.95 -27.43 62.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.012 1.325 . . . . 0.0 113.726 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -141.9 135.34 29.37 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.646 1.978 . . . . 0.0 111.458 178.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.8 t -80.01 149.52 30.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.267 1.427 . . . . 0.0 112.318 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.05 162.92 28.75 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.739 1.615 . . . . 0.0 111.257 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -132.52 151.24 51.98 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.778 0.831 . . . . 0.0 112.915 -175.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.9 m -144.78 162.36 38.86 Favored Pre-proline 0 N--CA 1.48 1.067 0 C-N-CA 126.581 1.952 . . . . 0.0 112.531 -169.02 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.99 142.37 81.16 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 123.106 2.537 . . . . 0.0 114.808 -175.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.401 1.48 . . . . 0.0 114.833 -176.223 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.1 m . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 56.45 30.21 16.66 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 126.515 1.926 . . . . 0.0 113.107 -169.088 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.03 -29.59 63.5 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -169.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.6 ttp85 -65.15 -45.77 83.63 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.393 1.451 . . . . 0.0 112.003 174.424 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.78 -40.62 97.88 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.735 0.814 . . . . 0.0 110.525 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.8 t -60.64 -51.72 68.2 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.32 1.448 . . . . 0.0 111.587 175.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.47 -46.78 86.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.37 1.068 . . . . 0.0 113.031 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pp -66.6 -33.53 75.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.941 1.701 . . . . 0.0 111.981 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.5 m -63.85 -46.45 84.95 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.238 0.615 . . . . 0.0 110.981 170.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -77.79 -30.63 51.39 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -61.0 -40.31 93.04 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.111 1.364 . . . . 0.0 110.677 167.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.9 m -67.12 -22.27 65.81 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.797 0.839 . . . . 0.0 113.014 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.72 -14.28 24.93 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.677 1.591 . . . . 0.0 113.782 173.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.79 24.66 24.89 Favored Glycine 0 CA--C 1.542 1.764 0 C-N-CA 125.981 1.753 . . . . 0.0 115.923 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.83 167.87 21.15 Favored 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 119.327 1.564 . . . . 0.0 113.865 -178.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 mt -92.17 136.24 33.35 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.849 1.26 . . . . 0.0 112.76 -170.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.37 149.31 21.84 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.057 0.837 . . . . 0.0 113.839 170.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -153.88 137.84 16.32 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.109 1.763 . . . . 0.0 112.078 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.6 t -83.24 118.18 23.46 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.171 -0.955 . . . . 0.0 110.299 169.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.6 mt -84.17 -35.3 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.824 0.85 . . . . 0.0 110.923 -175.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.8 -68.21 0.13 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.63 1.11 . . . . 0.0 112.67 177.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.69 -24.67 41.58 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.865 -0.786 . . . . 0.0 113.026 175.496 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -159.96 166.1 30.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.699 1.199 . . . . 0.0 112.398 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.1 t -96.19 133.56 40.36 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.673 1.189 . . . . 0.0 112.437 172.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -133.16 170.71 15.02 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.471 2.308 . . . . 0.0 109.05 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -126.54 154.42 43.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.2 m -146.71 152.39 44.74 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 126.615 1.966 . . . . 0.0 111.757 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.65 146.07 97.08 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 122.784 2.323 . . . . 0.0 113.769 176.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.351 0 C-N-CA 125.545 1.538 . . . . 0.0 111.57 169.768 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -120.29 12.09 11.67 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -169.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.9 t -143.93 114.75 7.74 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.468 1.107 . . . . 0.0 112.956 -176.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -81.58 55.53 2.69 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.515 1.926 . . . . 0.0 110.779 176.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -42.25 -43.57 3.48 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.157 2.183 . . . . 0.0 115.206 -169.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -66.51 -39.47 88.68 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 121.637 2.017 . . . . 0.0 113.869 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -59.09 -38.62 79.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.485 1.514 . . . . 0.0 111.395 170.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 57.9 m -67.24 -48.54 67.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.307 0.643 . . . . 0.0 112.447 172.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.53 -39.22 90.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.129 0.972 . . . . 0.0 112.382 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -74.26 -33.74 63.38 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.936 0.789 . . . . 0.0 112.241 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -63.23 -39.48 94.73 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.405 -0.809 . . . . 0.0 111.39 171.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -70.54 -41.56 72.36 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.768 -0.582 . . . . 0.0 111.792 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -57.0 -41.47 78.53 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.393 0.997 . . . . 0.0 111.022 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.1 m -62.25 -27.41 68.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.331 1.052 . . . . 0.0 113.775 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 tp -86.22 -43.82 12.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.653 1.981 . . . . 0.0 110.422 173.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 150.4 4.67 0.21 Allowed Glycine 0 CA--C 1.534 1.243 0 CA-C-O 117.187 -1.896 . . . . 0.0 117.243 169.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -144.37 177.84 8.35 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.925 2.362 . . . . 0.0 114.516 -168.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.32 159.09 32.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.168 0.987 . . . . 0.0 112.713 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.7 155.5 16.27 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.491 1.044 . . . . 0.0 113.579 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -145.61 150.69 36.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.907 1.683 . . . . 0.0 111.818 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.5 m -77.97 154.15 31.82 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.717 -0.615 . . . . 0.0 111.034 168.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.1 mm -113.33 -37.91 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.982 1.713 . . . . 0.0 110.171 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.77 -111.27 0.39 Allowed Glycine 0 N--CA 1.463 0.47 0 N-CA-C 108.686 -1.765 . . . . 0.0 108.686 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.74 2.73 9.34 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.956 0.902 . . . . 0.0 113.364 168.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -136.52 158.74 43.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.352 2.261 . . . . 0.0 110.425 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.1 p -130.19 152.27 49.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.448 1.499 . . . . 0.0 112.276 173.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -137.91 167.77 21.08 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.53 1.532 . . . . 0.0 112.53 -174.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -109.22 148.76 30.43 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.9 m -144.4 152.64 54.11 Favored Pre-proline 0 N--CA 1.48 1.038 0 C-N-CA 125.636 1.574 . . . . 0.0 113.018 -172.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -61.48 158.7 35.05 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.899 3.066 . . . . 0.0 116.153 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.472 0 C-N-CA 127.163 2.185 . . . . 0.0 115.14 176.838 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 122.551 1.167 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -103.18 46.63 0.91 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.031 1.333 . . . . 0.0 113.752 -172.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.8 m 53.96 19.4 1.99 Allowed 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 118.543 2.794 . . . . 0.0 118.543 168.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 57.11 32.64 22.03 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-N 119.759 1.163 . . . . 0.0 111.748 -166.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.62 -37.27 79.62 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.926 1.69 . . . . 0.0 112.768 -173.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -43.24 78.75 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.514 1.052 . . . . 0.0 110.013 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 54.5 mtt85 -69.89 -36.74 75.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.57 1.548 . . . . 0.0 112.449 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.2 t -65.43 -53.02 49.0 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.533 0.683 . . . . 0.0 111.128 173.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -23.63 59.32 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.031 -1.043 . . . . 0.0 113.365 -172.055 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.1 tp -59.04 -46.97 86.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.965 1.706 . . . . 0.0 110.905 168.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 t -61.3 -34.24 74.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.684 0.793 . . . . 0.0 111.751 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.98 -41.91 58.6 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.79 1.236 . . . . 0.0 112.657 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -63.79 -31.04 72.09 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.198 1.399 . . . . 0.0 112.158 175.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.0 m -62.81 -4.68 2.24 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.775 1.23 . . . . 0.0 113.647 167.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -122.38 -4.1 8.88 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.175 2.19 . . . . 0.0 112.854 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.43 -6.43 71.33 Favored Glycine 0 CA--C 1.542 1.746 0 C-N-CA 126.777 2.132 . . . . 0.0 116.242 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.83 157.1 35.58 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.912 2.085 . . . . 0.0 112.922 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.1 mt -110.81 151.82 27.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.507 1.523 . . . . 0.0 109.623 169.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.33 157.06 17.0 Favored Glycine 0 N--CA 1.476 1.327 0 CA-C-N 119.349 0.977 . . . . 0.0 114.508 -178.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -146.74 144.74 29.62 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.855 1.662 . . . . 0.0 112.374 173.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.76 122.95 26.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.103 0.561 . . . . 0.0 110.879 171.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.9 mm -81.16 -22.6 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.586 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.48 -68.16 0.5 Allowed Glycine 0 CA--C 1.524 0.651 0 C-N-CA 126.637 2.065 . . . . 0.0 110.685 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -87.58 -19.42 27.84 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.052 1.741 . . . . 0.0 113.083 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -137.17 162.2 34.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.558 1.943 . . . . 0.0 111.425 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.12 151.24 21.19 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.033 1.333 . . . . 0.0 110.046 168.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -138.63 146.86 42.21 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.333 1.053 . . . . 0.0 110.706 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -115.38 154.97 28.24 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.51 1.124 . . . . 0.0 113.221 173.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.6 m -143.46 155.88 60.59 Favored Pre-proline 0 N--CA 1.471 0.603 0 C-N-CA 126.654 1.982 . . . . 0.0 110.775 -173.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -66.09 156.63 63.73 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.551 2.167 . . . . 0.0 113.289 173.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.218 0 C-N-CA 125.218 1.407 . . . . 0.0 113.199 179.774 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.821 0 CA-C-O 120.514 0.197 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -76.43 -178.98 4.9 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.724 1.21 . . . . 0.0 113.513 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.7 p -123.96 23.46 8.57 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.902 2.081 . . . . 0.0 112.987 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.255 4.5 m-80 57.94 23.65 10.1 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.479 2.312 . . . . 0.0 115.907 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -50.93 -37.02 41.63 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.287 1.035 . . . . 0.0 112.708 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -58.22 -33.22 69.08 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -175.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -97.73 -30.24 12.92 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.476 1.035 . . . . 0.0 112.492 172.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -57.01 -48.08 79.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.103 0.961 . . . . 0.0 112.288 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -53.83 -42.11 68.12 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.309 1.044 . . . . 0.0 112.319 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.54 -44.68 70.46 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.248 2.219 . . . . 0.0 111.445 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 t -71.26 -34.7 70.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.783 1.233 . . . . 0.0 112.617 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 57.6 m -71.59 -27.44 63.13 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.487 -0.758 . . . . 0.0 111.608 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -56.64 -31.83 64.73 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.618 1.167 . . . . 0.0 112.212 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.8 t -62.28 -22.58 66.12 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.82 1.248 . . . . 0.0 113.878 174.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.2 mt -105.65 -7.35 18.54 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.934 1.694 . . . . 0.0 113.124 173.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.0 21.35 25.78 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.516 1.531 . . . . 0.0 116.171 173.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.9 167.21 22.52 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.008 1.404 . . . . 0.0 113.278 -177.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.6 mt -79.33 167.59 20.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.453 1.501 . . . . 0.0 112.178 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.51 137.29 14.14 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.859 1.218 . . . . 0.0 111.969 169.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -132.72 138.01 47.09 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.353 1.461 . . . . 0.0 110.735 176.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 89.5 m -70.49 124.88 25.28 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 171.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -110.51 78.68 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 127.37 2.268 . . . . 0.0 106.805 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.42 -124.38 7.18 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 125.932 1.73 . . . . 0.0 112.415 -172.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -74.57 3.18 8.13 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.498 2.319 . . . . 0.0 114.788 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -151.15 136.25 17.5 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.523 1.129 . . . . 0.0 111.674 -166.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -95.24 138.59 32.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.538 0.735 . . . . 0.0 112.711 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -132.19 156.28 46.72 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.494 2.318 . . . . 0.0 110.644 -177.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.4 m -82.67 137.28 34.51 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.591 -0.693 . . . . 0.0 112.399 -175.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 m -136.38 145.27 51.05 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 125.132 1.373 . . . . 0.0 112.776 -173.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.66 151.49 83.34 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.248 2.632 . . . . 0.0 113.752 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.134 1.374 . . . . 0.0 113.752 174.908 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -145.23 149.59 35.19 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.387 1.475 . . . . 0.0 110.748 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.7 m -74.2 94.78 2.5 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.013 0.525 . . . . 0.0 112.348 173.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -83.82 55.05 3.1 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.615 1.166 . . . . 0.0 108.879 170.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 19.3 tp -52.45 -33.1 42.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.703 1.601 . . . . 0.0 115.169 -168.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 66.1 ttp85 -62.73 -48.97 76.9 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.768 1.622 . . . . 0.0 112.571 173.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -65.87 -29.6 70.08 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.603 0.761 . . . . 0.0 112.198 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.5 m -68.84 -51.09 44.29 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.672 0.789 . . . . 0.0 110.88 169.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -60.06 -43.3 95.53 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.165 0.986 . . . . 0.0 112.301 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 pp -69.55 -34.66 74.51 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.003 0.82 . . . . 0.0 111.989 -178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -63.73 -47.35 81.42 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.873 0.869 . . . . 0.0 111.1 171.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.79 -37.23 62.43 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 118.118 0.417 . . . . 0.0 112.089 -176.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -61.33 -33.71 74.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.802 1.241 . . . . 0.0 111.738 173.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 m -67.65 -2.45 6.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 171.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.0 mt -124.08 9.96 8.73 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.268 2.227 . . . . 0.0 112.476 172.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.64 -4.86 62.95 Favored Glycine 0 CA--C 1.541 1.689 0 N-CA-C 116.159 1.224 . . . . 0.0 116.159 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.16 171.12 11.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.347 2.259 . . . . 0.0 113.174 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -123.53 137.05 54.85 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.338 1.855 . . . . 0.0 108.738 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.13 136.31 13.47 Favored Glycine 0 N--CA 1.468 0.82 0 C-N-CA 125.534 1.54 . . . . 0.0 114.583 -176.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -134.42 140.93 46.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.493 1.917 . . . . 0.0 110.881 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.5 t -76.37 140.17 41.29 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.195 -0.941 . . . . 0.0 111.728 169.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.8 mt -85.02 -58.27 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.127 0.971 . . . . 0.0 109.729 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -168.09 -49.37 0.03 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.863 1.697 . . . . 0.0 112.073 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.82 -11.94 6.57 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.623 1.569 . . . . 0.0 113.753 170.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -115.63 149.38 38.4 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.853 1.661 . . . . 0.0 113.181 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.1 m -83.93 147.9 27.23 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.416 1.086 . . . . 0.0 111.951 167.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -131.4 130.09 42.14 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.587 1.955 . . . . 0.0 109.245 170.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.6 m -119.71 136.99 54.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.272 0.629 . . . . 0.0 112.359 177.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -137.95 161.99 56.66 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.846 1.658 . . . . 0.0 110.379 -173.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.83 156.75 41.65 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.388 2.059 . . . . 0.0 113.052 172.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.32 175.329 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 120.431 0.158 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.38 157.24 22.6 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.53 1.532 . . . . 0.0 111.998 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m -114.34 154.2 28.46 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.94 1.296 . . . . 0.0 113.527 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -78.49 40.42 0.37 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.338 1.455 . . . . 0.0 111.211 169.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 15.3 tp -57.15 -31.61 65.54 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.117 1.367 . . . . 0.0 114.331 -167.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -58.85 -35.44 72.93 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.466 1.106 . . . . 0.0 113.124 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -81.79 -35.93 28.98 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.14 1.376 . . . . 0.0 111.642 173.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -61.86 -45.78 92.32 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.164 0.586 . . . . 0.0 112.063 178.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -56.57 -45.91 81.04 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.853 -0.529 . . . . 0.0 111.856 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -70.08 -39.25 75.71 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.868 2.067 . . . . 0.0 111.591 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.3 m -60.44 -46.19 90.95 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.247 1.019 . . . . 0.0 110.868 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.5 m -78.0 -29.66 49.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.527 0.731 . . . . 0.0 112.216 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.66 -38.26 89.63 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 120.375 -1.453 . . . . 0.0 111.255 170.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.5 m -70.01 -14.07 62.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.771 1.229 . . . . 0.0 114.103 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -103.26 -14.95 16.13 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.082 1.353 . . . . 0.0 113.159 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.18 37.28 6.32 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.471 1.51 . . . . 0.0 115.286 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -150.94 163.6 38.31 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 118.976 1.388 . . . . 0.0 113.301 175.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.0 mp -90.6 158.43 16.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.269 1.828 . . . . 0.0 111.883 -172.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.87 154.25 16.47 Favored Glycine 0 N--CA 1.478 1.49 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -151.16 140.22 21.11 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.129 1.772 . . . . 0.0 113.244 173.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.8 t -75.51 138.84 41.82 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 120.787 -1.196 . . . . 0.0 111.992 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.3 mt -142.25 103.33 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 122.33 1.062 . . . . 0.0 112.074 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 -60.16 2.84 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 127.942 2.687 . . . . 0.0 114.582 168.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.26 5.6 0.64 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -159.7 154.62 24.68 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.073 0.851 . . . . 0.0 110.968 -178.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.98 146.64 27.89 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.292 -0.88 . . . . 0.0 112.695 177.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -128.63 158.41 38.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.7 1.6 . . . . 0.0 109.86 171.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 88.2 m -119.16 153.71 34.45 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.734 0.778 . . . . 0.0 112.63 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 m -140.73 151.48 63.23 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 126.287 1.835 . . . . 0.0 111.837 -168.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -65.44 155.98 65.89 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.902 2.401 . . . . 0.0 116.648 -168.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.385 0 C-N-CA 126.824 2.05 . . . . 0.0 114.298 174.919 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -97.93 158.45 15.53 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.334 1.054 . . . . 0.0 113.46 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.9 t -115.07 150.07 36.51 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.773 1.629 . . . . 0.0 111.31 171.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -71.58 34.75 0.06 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.302 1.841 . . . . 0.0 112.524 169.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -49.16 -46.7 45.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.686 1.994 . . . . 0.0 113.737 -167.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -67.9 -37.38 81.65 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -64.25 -42.57 96.45 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.312 1.445 . . . . 0.0 110.988 169.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.0 m -66.03 -43.14 88.49 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.221 0.608 . . . . 0.0 111.888 179.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -62.78 -35.41 79.75 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.884 -1.135 . . . . 0.0 112.58 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 tp -69.67 -37.54 76.73 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.791 1.636 . . . . 0.0 111.027 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.4 t -65.25 -44.51 87.9 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.074 -1.016 . . . . 0.0 111.33 173.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.9 m -70.65 -26.59 63.53 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.143 -0.973 . . . . 0.0 112.222 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -60.63 -24.71 65.75 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.043 -1.036 . . . . 0.0 112.396 170.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.3 p -63.38 -38.9 92.92 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.466 1.03 . . . . 0.0 112.848 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.4 mt -98.39 12.5 34.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.377 1.471 . . . . 0.0 113.045 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.49 22.11 56.99 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.725 1.45 . . . . 0.0 116.725 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.11 -174.56 3.58 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.211 1.506 . . . . 0.0 113.844 -175.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -97.76 156.45 16.56 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.673 1.589 . . . . 0.0 111.905 -174.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.04 150.67 17.14 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 124.723 1.154 . . . . 0.0 114.329 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -137.93 149.47 46.21 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.016 2.126 . . . . 0.0 112.159 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.2 m -91.05 145.5 24.64 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.789 1.236 . . . . 0.0 112.632 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.7 mm -139.83 74.78 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.573 1.549 . . . . 0.0 108.715 169.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.02 -120.06 8.39 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.225 1.393 . . . . 0.0 112.974 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -75.09 -5.53 44.71 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.474 -1.015 . . . . 0.0 113.425 172.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -120.13 177.9 4.83 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.894 1.678 . . . . 0.0 111.717 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 30.1 m -136.09 162.47 32.81 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 125.073 1.349 . . . . 0.0 112.591 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -136.01 175.73 9.33 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.357 2.263 . . . . 0.0 110.767 171.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.4 m -116.14 164.38 14.56 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.581 0.752 . . . . 0.0 110.59 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -142.12 149.21 51.37 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.947 1.699 . . . . 0.0 110.348 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.1 139.58 85.54 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.688 2.259 . . . . 0.0 112.018 177.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.293 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -176.643 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.711 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -80.69 163.43 23.58 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.02 1.328 . . . . 0.0 113.105 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.2 t -68.1 129.61 40.44 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.655 1.182 . . . . 0.0 113.656 -172.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -81.02 54.3 2.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.574 1.549 . . . . 0.0 110.985 168.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.4 tt -47.83 -39.22 17.79 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.939 2.096 . . . . 0.0 112.891 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -59.81 -40.27 87.82 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.705 1.202 . . . . 0.0 113.573 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -71.0 -36.39 72.45 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.078 1.751 . . . . 0.0 111.657 172.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.4 m -66.33 -43.28 86.6 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.191 0.905 . . . . 0.0 112.8 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 49.4 mt-10 -62.26 -38.47 89.4 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.035 -1.04 . . . . 0.0 112.547 176.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.5 -42.51 87.27 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.02 1.728 . . . . 0.0 110.347 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -59.84 -47.91 83.84 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.361 1.065 . . . . 0.0 111.592 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.0 m -74.04 -21.16 60.06 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.958 -1.089 . . . . 0.0 112.931 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -61.76 -22.05 65.07 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.921 -1.112 . . . . 0.0 112.549 169.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 p -74.55 -28.4 60.93 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 170.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.2 mt -90.84 -15.72 29.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.675 1.99 . . . . 0.0 113.319 177.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.13 18.11 11.77 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.527 1.537 . . . . 0.0 116.053 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -155.12 -178.12 7.02 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 119.743 1.772 . . . . 0.0 113.26 -173.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.58 167.19 21.63 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.219 1.408 . . . . 0.0 111.264 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.405 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -142.98 146.04 16.5 Favored Glycine 0 N--CA 1.473 1.145 0 O-C-N 121.029 -1.044 . . . . 0.0 114.915 -174.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -147.24 152.6 38.59 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.962 2.105 . . . . 0.0 110.393 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.8 m -77.74 131.8 37.83 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.123 -0.986 . . . . 0.0 112.301 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.8 mm -130.18 87.1 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-O 122.866 1.317 . . . . 0.0 108.674 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.13 -143.79 31.26 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 113.85 -1.523 . . . . 0.0 112.383 -170.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -74.83 21.74 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -155.83 149.36 24.92 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.665 -1.272 . . . . 0.0 112.304 -175.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.7 m -79.95 135.26 36.36 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 113.297 175.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -117.77 158.96 23.83 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.655 1.982 . . . . 0.0 110.032 167.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.4 m -113.87 149.03 35.68 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -169.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.8 m -135.11 153.06 78.1 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 125.794 1.637 . . . . 0.0 112.041 -170.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -67.77 151.11 79.08 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.813 2.342 . . . . 0.0 115.683 -169.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.607 1.563 . . . . 0.0 113.882 171.501 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.495 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -96.02 153.1 17.95 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.916 1.286 . . . . 0.0 112.791 -174.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.3 t -82.52 148.42 28.11 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.473 0.709 . . . . 0.0 112.862 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -81.28 49.76 1.33 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.549 1.939 . . . . 0.0 112.036 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.4 tp -61.81 -40.77 96.41 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -172.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -66.48 -33.43 75.67 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.1 1.318 . . . . 0.0 112.061 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -73.64 -38.64 64.95 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.908 0.883 . . . . 0.0 112.224 168.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -59.17 -42.22 90.29 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.024 0.829 . . . . 0.0 111.563 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.38 -47.52 78.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.168 0.987 . . . . 0.0 112.632 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.3 tp -73.06 -29.99 63.37 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.862 1.665 . . . . 0.0 112.119 -177.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.0 t -63.94 -36.87 85.37 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.433 1.093 . . . . 0.0 111.649 169.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.47 -30.93 33.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.273 -0.892 . . . . 0.0 113.008 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -52.26 -36.63 53.15 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.003 0.921 . . . . 0.0 111.57 169.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 p -57.44 -28.63 63.5 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.4 mt -104.38 5.47 34.4 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.56 1.944 . . . . 0.0 113.698 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.14 12.42 67.98 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.57 178.24 7.15 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.594 1.697 . . . . 0.0 112.608 -177.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.0 mt -83.03 160.33 21.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.588 1.155 . . . . 0.0 111.906 -176.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.9 153.0 17.57 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 123.83 0.729 . . . . 0.0 112.672 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -149.88 132.07 15.44 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.87 0.868 . . . . 0.0 111.679 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.5 t -86.18 124.77 32.95 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.79 0.436 . . . . 0.0 110.611 169.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.19 33.82 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.811 1.644 . . . . 0.0 110.553 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.34 -64.5 1.36 Allowed Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.769 1.652 . . . . 0.0 113.317 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -74.83 -33.87 62.23 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.276 1.43 . . . . 0.0 113.504 -176.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -158.79 155.3 27.66 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.466 1.106 . . . . 0.0 112.593 -168.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -83.69 143.93 29.72 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.604 1.162 . . . . 0.0 111.355 169.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -151.09 161.08 43.4 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.185 1.394 . . . . 0.0 111.959 167.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 m -94.7 150.42 20.24 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -141.97 148.48 48.98 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 125.774 1.63 . . . . 0.0 111.136 -173.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -65.61 138.07 52.79 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.203 2.602 . . . . 0.0 113.965 -172.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.073 1.749 . . . . 0.0 113.746 179.561 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -65.6 146.91 54.24 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.445 0.641 . . . . 0.0 112.315 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.7 p -67.36 144.49 55.78 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 122.278 1.037 . . . . 0.0 113.485 178.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -79.1 49.85 0.99 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 128.312 2.645 . . . . 0.0 111.612 177.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -47.48 -37.82 12.58 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.972 1.309 . . . . 0.0 113.445 -170.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -57.46 -45.06 85.19 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.175 0.99 . . . . 0.0 113.63 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.13 -37.26 66.72 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.173 1.789 . . . . 0.0 110.889 173.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 64.2 m -60.48 -43.37 97.05 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.413 0.685 . . . . 0.0 112.826 175.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -56.27 -47.04 79.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.534 1.061 . . . . 0.0 110.947 172.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tp -63.21 -39.53 94.88 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.566 1.546 . . . . 0.0 111.503 177.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 m -63.06 -37.82 88.73 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.503 1.521 . . . . 0.0 113.186 171.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 64.5 m -78.08 -34.92 49.98 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.627 -0.671 . . . . 0.0 111.904 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -30.53 71.36 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.857 -1.152 . . . . 0.0 111.762 176.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.7 t -63.24 -41.64 99.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 0.0 111.676 168.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.15 -6.41 54.69 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.151 1.38 . . . . 0.0 113.662 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.54 13.15 56.09 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 125.981 1.753 . . . . 0.0 115.79 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -141.63 171.86 13.48 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.898 1.349 . . . . 0.0 113.404 -175.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.4 mt -75.07 151.09 38.69 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 112.289 -173.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.34 136.88 12.94 Favored Glycine 0 N--CA 1.471 0.98 0 O-C-N 121.409 -0.807 . . . . 0.0 112.864 173.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -143.55 166.93 23.46 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.848 1.659 . . . . 0.0 110.874 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 t -150.07 153.43 36.42 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -173.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -129.48 103.07 8.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 126.349 1.859 . . . . 0.0 107.53 167.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.03 -102.3 0.34 Allowed Glycine 0 CA--C 1.534 1.278 0 C-N-CA 127.087 2.28 . . . . 0.0 114.533 176.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.03 10.48 28.88 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.816 2.047 . . . . 0.0 113.034 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -143.15 115.6 8.55 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.138 -1.601 . . . . 0.0 113.677 -173.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.2 m -84.6 138.91 32.45 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.66 1.584 . . . . 0.0 112.311 169.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.17 135.88 26.0 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.354 1.462 . . . . 0.0 110.495 169.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 m -78.32 153.43 31.73 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.9 m -141.82 148.95 51.43 Favored Pre-proline 0 N--CA 1.478 0.942 0 C-N-CA 124.856 1.263 . . . . 0.0 112.054 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_exo -67.67 161.74 42.38 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.658 2.239 . . . . 0.0 112.961 170.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.258 1.533 0 C-N-CA 124.748 1.219 . . . . 0.0 112.765 174.179 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.138 0.494 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 57.15 30.45 18.34 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 115.629 1.715 . . . . 0.0 115.629 169.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.8 p -82.95 -1.14 51.62 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -178.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.9 m120 51.73 32.92 10.12 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 127.511 2.324 . . . . 0.0 114.897 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.7 -31.0 24.3 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 -168.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -59.02 -40.19 84.24 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.12 1.327 . . . . 0.0 112.245 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 mmm180 -70.34 -39.78 74.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.469 1.107 . . . . 0.0 111.569 174.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.3 m -67.62 -43.7 79.77 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.269 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.42 -34.72 78.85 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.196 -0.94 . . . . 0.0 113.194 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tp -66.93 -36.69 82.8 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 110.393 171.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.9 m -66.88 -42.44 85.56 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.463 -0.773 . . . . 0.0 111.397 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.96 -36.86 75.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.879 0.763 . . . . 0.0 111.669 175.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -54.65 -40.71 69.28 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.995 -1.065 . . . . 0.0 111.163 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.1 m -75.01 3.27 8.66 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.885 1.674 . . . . 0.0 114.693 176.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -123.9 2.47 8.74 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.008 2.123 . . . . 0.0 112.271 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.35 19.53 66.41 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 125.387 1.47 . . . . 0.0 115.884 177.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -139.9 173.32 11.64 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.81 1.805 . . . . 0.0 112.747 -177.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.6 mt -86.58 176.74 7.65 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.164 1.386 . . . . 0.0 111.553 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -154.46 153.92 25.15 Favored Glycine 0 N--CA 1.474 1.171 0 O-C-N 120.902 -1.124 . . . . 0.0 115.128 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -141.32 147.43 38.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.446 1.498 . . . . 0.0 112.226 -174.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.1 t -81.64 133.85 35.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.747 0.819 . . . . 0.0 112.178 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.0 mt -122.32 65.08 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 127.075 2.15 . . . . 0.0 108.877 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.95 -69.73 0.78 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 127.209 2.337 . . . . 0.0 115.016 176.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -100.74 -18.03 16.67 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.031 1.332 . . . . 0.0 112.954 -174.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -146.52 176.32 9.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 126.371 1.868 . . . . 0.0 112.143 -169.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 29.6 p -126.82 142.68 51.48 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.896 1.278 . . . . 0.0 111.396 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -135.6 150.73 49.76 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.151 0.98 . . . . 0.0 111.853 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 m -79.55 155.03 28.38 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 169.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -143.51 151.0 53.1 Favored Pre-proline 0 N--CA 1.476 0.852 0 C-N-CA 126.206 1.803 . . . . 0.0 111.039 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -59.2 146.7 93.68 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.192 2.595 . . . . 0.0 114.954 -173.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.966 1.706 . . . . 0.0 112.487 173.41 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -83.46 -11.91 56.96 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 170.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m -69.38 100.71 1.41 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.979 1.312 . . . . 0.0 108.06 166.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.42 45.53 0.67 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.54 1.536 . . . . 0.0 111.14 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.48 -38.49 44.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.463 2.305 . . . . 0.0 113.063 -168.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -64.31 -35.35 80.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.313 -0.867 . . . . 0.0 112.773 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -85.56 -32.15 22.29 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.359 1.464 . . . . 0.0 113.545 171.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -68.46 -35.46 77.59 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.089 0.859 . . . . 0.0 112.354 176.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.23 -36.47 66.05 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.194 -1.566 . . . . 0.0 111.954 169.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.4 tp -82.05 -37.78 25.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.06 1.744 . . . . 0.0 111.37 -177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 83.6 p -65.0 -41.81 95.06 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.474 1.033 . . . . 0.0 111.179 175.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.25 -41.92 84.81 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.008 -0.432 . . . . 0.0 110.425 174.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -61.86 -33.35 74.03 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.811 -1.181 . . . . 0.0 112.402 176.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 41.7 t -66.4 -29.35 69.48 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.064 0.946 . . . . 0.0 112.658 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.79 -48.04 17.51 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.92 -1.112 . . . . 0.0 111.126 170.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 144.65 15.71 0.22 Allowed Glycine 0 CA--C 1.537 1.453 0 CA-C-O 117.82 -1.544 . . . . 0.0 116.098 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.94 179.53 7.41 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 120.202 2.001 . . . . 0.0 113.132 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.3 mt -88.46 160.05 17.7 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.851 -1.155 . . . . 0.0 112.844 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.26 138.7 15.14 Favored Glycine 0 N--CA 1.469 0.881 0 C-N-CA 124.295 0.95 . . . . 0.0 113.801 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -141.7 171.25 14.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.354 2.261 . . . . 0.0 109.826 172.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.0 t -150.06 139.01 20.99 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 -174.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.8 mm -117.91 115.41 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.468 1.907 . . . . 0.0 110.57 -174.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -87.03 0.18 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 126.139 1.828 . . . . 0.0 111.676 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 50.0 mp0 -129.42 5.23 5.18 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.17 1.788 . . . . 0.0 112.71 172.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -115.77 117.17 29.49 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.169 0.988 . . . . 0.0 113.163 -168.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.0 m -74.36 138.98 43.78 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 120.569 -1.332 . . . . 0.0 113.153 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -147.13 127.22 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.793 1.637 . . . . 0.0 111.285 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.8 m -77.65 147.69 35.42 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -130.18 148.29 69.15 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 126.532 1.933 . . . . 0.0 110.64 -175.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -65.26 145.29 83.51 Favored 'Trans proline' 0 C--O 1.239 0.547 0 C-N-CA 122.44 2.094 . . . . 0.0 112.901 -171.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 C-N-CA 125.493 1.517 . . . . 0.0 111.158 177.138 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 120.689 0.281 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -88.63 154.13 20.57 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.238 1.015 . . . . 0.0 113.281 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.5 t -154.1 162.85 40.91 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 126.152 1.781 . . . . 0.0 111.278 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -111.65 66.5 0.63 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.196 1.798 . . . . 0.0 111.401 -168.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.56 -42.08 15.32 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.207 1.803 . . . . 0.0 114.073 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -65.43 -34.04 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 120.24 -1.538 . . . . 0.0 113.519 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -73.1 -38.14 66.48 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.955 0.902 . . . . 0.0 111.29 172.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.7 t -62.65 -40.84 98.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.473 1.109 . . . . 0.0 112.098 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -58.25 -41.54 84.46 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.864 1.265 . . . . 0.0 112.446 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.2 tp -69.71 -42.71 73.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.377 0.989 . . . . 0.0 110.125 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.9 t -57.82 -39.02 76.62 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.788 -0.57 . . . . 0.0 112.485 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.4 m -79.67 -32.92 41.55 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.474 -0.766 . . . . 0.0 112.975 175.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -60.49 -29.65 69.21 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.644 -1.285 . . . . 0.0 112.539 170.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.6 p -67.64 -14.47 62.97 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 172.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -103.24 -24.71 13.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.151 1.78 . . . . 0.0 112.502 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.01 2.14 28.38 Favored Glycine 0 CA--C 1.542 1.759 0 C-N-CA 125.905 1.717 . . . . 0.0 116.076 174.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.449 ' H ' HD23 ' A' ' 17' ' ' LEU . 1.8 pt? -121.24 171.96 8.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.983 1.713 . . . . 0.0 112.347 -178.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -73.74 154.31 39.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.952 1.301 . . . . 0.0 112.117 -173.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.95 141.89 15.61 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 123.933 0.778 . . . . 0.0 113.938 175.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -138.2 153.39 49.16 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.602 1.561 . . . . 0.0 111.729 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 m -100.19 95.28 6.71 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.247 1.419 . . . . 0.0 110.183 172.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -82.86 68.65 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-O 123.204 1.478 . . . . 0.0 110.146 -176.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.84 -92.33 0.19 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 127.083 2.278 . . . . 0.0 111.879 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -66.78 -28.61 68.53 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 -177.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -155.96 168.06 28.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.75 1.613 . . . . 0.0 114.739 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 t -70.92 132.8 45.77 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.932 0.893 . . . . 0.0 112.712 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -140.07 139.24 35.86 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.15 1.38 . . . . 0.0 110.12 168.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.6 m -87.19 152.69 22.1 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.825 -0.547 . . . . 0.0 112.24 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -138.79 151.8 69.25 Favored Pre-proline 0 N--CA 1.48 1.03 0 C-N-CA 125.088 1.355 . . . . 0.0 111.848 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -65.23 130.5 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 122.713 2.275 . . . . 0.0 111.293 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.404 0 C-N-CA 124.807 1.243 . . . . 0.0 113.417 -174.635 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 119.696 -0.192 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -117.2 5.02 12.65 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.053 1.341 . . . . 0.0 114.303 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.3 p -66.02 164.19 15.77 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.061 1.745 . . . . 0.0 112.789 176.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -84.93 44.2 1.05 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.543 1.937 . . . . 0.0 112.754 -176.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.97 -39.61 90.52 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.36 1.464 . . . . 0.0 113.062 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -44.51 68.91 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.244 1.418 . . . . 0.0 110.865 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -69.28 -38.06 78.18 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.978 1.711 . . . . 0.0 112.97 172.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.75 -41.43 97.66 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.502 0.592 . . . . 0.0 112.478 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -63.06 -34.74 78.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.22 -0.925 . . . . 0.0 112.288 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -45.29 65.49 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.738 2.415 . . . . 0.0 110.839 174.496 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.0 t -58.4 -48.95 79.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.568 1.147 . . . . 0.0 111.509 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -70.88 -31.94 68.75 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.381 -0.824 . . . . 0.0 111.871 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -60.89 -24.79 66.24 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.618 -1.301 . . . . 0.0 113.244 169.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 p -61.84 -28.91 69.82 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.279 1.399 . . . . 0.0 112.326 173.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.06 -2.5 27.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.222 2.209 . . . . 0.0 113.404 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.63 30.83 20.32 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 174.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.5 171.87 13.46 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 119.812 1.806 . . . . 0.0 113.73 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.3 mt -79.25 170.96 15.85 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.977 1.711 . . . . 0.0 112.291 -175.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.99 146.58 17.94 Favored Glycine 0 CA--C 1.537 1.411 0 N-CA-C 115.401 0.92 . . . . 0.0 115.401 -175.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -140.6 156.33 46.31 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.593 2.357 . . . . 0.0 111.508 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.1 p -110.05 55.4 0.64 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.108 1.363 . . . . 0.0 112.512 174.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.9 mm -55.49 -47.6 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.297 1.439 . . . . 0.0 113.446 -168.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -107.9 41.66 2.15 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.652 1.596 . . . . 0.0 112.257 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 64.21 -33.4 0.14 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 127.37 2.268 . . . . 0.0 114.837 -169.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -79.59 150.78 30.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.951 1.701 . . . . 0.0 112.096 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -65.16 131.68 47.17 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -176.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -129.14 128.5 43.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.255 2.222 . . . . 0.0 109.099 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 27.9 m -85.1 147.52 26.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 174.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.3 m -137.07 149.3 65.88 Favored Pre-proline 0 N--CA 1.479 1.011 0 C-N-CA 124.912 1.285 . . . . 0.0 112.107 -170.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.04 137.72 38.29 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 123.297 2.665 . . . . 0.0 114.404 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 C-N-CA 126.574 1.95 . . . . 0.0 113.114 -178.971 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 110.55 -0.167 . . . . 0.0 110.55 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -88.22 64.1 7.5 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.559 1.944 . . . . 0.0 110.058 -176.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.3 m -53.47 143.02 20.5 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 -166.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.41 36.62 0.43 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.507 1.923 . . . . 0.0 112.492 174.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mt -55.87 -48.01 76.34 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.021 1.328 . . . . 0.0 113.453 -170.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.7 ttp85 -63.8 -34.81 78.74 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.656 -1.278 . . . . 0.0 111.341 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -72.08 -34.31 68.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 126.883 2.073 . . . . 0.0 113.906 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.91 -40.38 28.35 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.782 0.719 . . . . 0.0 112.127 175.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -53.39 -35.07 59.96 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.63 1.572 . . . . 0.0 112.974 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.32 -31.6 72.49 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.591 1.087 . . . . 0.0 112.994 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.0 t -77.6 -39.33 45.9 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.409 1.084 . . . . 0.0 111.07 171.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.9 m -66.3 -38.64 88.22 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.084 -1.01 . . . . 0.0 111.372 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -43.48 89.82 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.52 1.128 . . . . 0.0 111.196 170.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -59.3 -32.89 70.46 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.484 0.714 . . . . 0.0 112.872 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 97.0 mt -91.17 -4.8 55.8 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.006 1.722 . . . . 0.0 113.632 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 29.88 57.74 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.711 1.624 . . . . 0.0 115.907 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.31 178.43 7.42 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 118.42 1.11 . . . . 0.0 112.489 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -91.58 147.62 22.87 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.975 -1.078 . . . . 0.0 112.415 -169.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -88.77 137.39 14.22 Favored Glycine 0 CA--C 1.533 1.167 0 O-C-N 121.462 -0.773 . . . . 0.0 112.368 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -145.26 137.02 25.47 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.701 1.2 . . . . 0.0 111.023 176.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -81.67 73.68 8.7 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.415 -0.803 . . . . 0.0 110.901 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 pt -64.12 -17.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -170.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.17 115.84 0.34 Allowed Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.458 1.028 . . . . 0.0 111.908 169.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 61.99 -35.74 0.11 Allowed 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 128.951 2.9 . . . . 0.0 115.889 -172.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -139.17 158.01 44.93 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 127.556 2.342 . . . . 0.0 110.644 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -87.21 140.79 29.19 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.033 1.123 . . . . 0.0 114.033 -178.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -134.44 156.67 48.15 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.996 1.719 . . . . 0.0 108.982 168.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 5.6 m -85.05 144.71 28.08 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.054 -0.404 . . . . 0.0 111.436 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.7 m -135.93 148.19 64.02 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 125.81 1.644 . . . . 0.0 111.016 -173.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.16 151.67 72.48 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.661 2.241 . . . . 0.0 111.382 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.337 0 C-N-CA 125.19 1.396 . . . . 0.0 112.073 174.989 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.9 0.381 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -57.82 157.92 6.97 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.651 1.18 . . . . 0.0 113.007 177.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.3 t -68.35 -3.02 9.64 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -169.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 m120 56.65 47.51 18.24 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.415 2.286 . . . . 0.0 111.654 -169.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.0 tt -53.86 -34.64 59.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.461 1.504 . . . . 0.0 113.193 -174.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.8 ttp180 -69.06 -32.85 72.61 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.762 0.825 . . . . 0.0 112.287 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -69.64 -43.69 72.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.655 1.182 . . . . 0.0 110.432 170.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -58.34 -49.26 77.85 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.864 176.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.11 -41.92 84.62 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.889 0.876 . . . . 0.0 113.191 174.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.72 -39.88 95.39 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.953 1.301 . . . . 0.0 110.802 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 p -59.88 -36.73 77.55 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.605 -0.684 . . . . 0.0 112.253 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.4 m -85.6 -37.01 20.01 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.99 0.916 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -56.8 -39.61 74.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.883 1.673 . . . . 0.0 112.067 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 m -62.36 -23.15 66.64 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.186 0.994 . . . . 0.0 113.108 175.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.7 mt -103.79 7.05 37.08 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 127.649 2.38 . . . . 0.0 113.714 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.5 23.07 61.14 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 125.099 1.333 . . . . 0.0 116.287 174.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.84 176.76 9.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.749 1.775 . . . . 0.0 113.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.8 mt -91.23 151.98 20.7 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.802 0.841 . . . . 0.0 112.537 -169.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.96 142.82 16.19 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.285 0.945 . . . . 0.0 114.314 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -134.57 114.36 12.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.324 1.45 . . . . 0.0 109.321 177.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -105.88 117.43 34.02 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.229 1.012 . . . . 0.0 110.719 -171.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -83.06 -45.7 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 124.354 1.061 . . . . 0.0 111.142 -170.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.57 107.0 0.79 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 126.442 1.973 . . . . 0.0 109.078 -169.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 60.68 4.99 0.83 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.055 1.742 . . . . 0.0 115.606 -167.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -149.8 147.32 27.86 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.446 1.498 . . . . 0.0 112.351 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.5 t -127.27 143.76 51.18 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.387 1.875 . . . . 0.0 110.833 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -136.07 159.11 42.73 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.674 1.99 . . . . 0.0 109.739 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 m -101.31 152.4 20.74 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.1 m -133.55 144.95 54.32 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.661 1.585 . . . . 0.0 111.969 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -62.17 150.39 86.93 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.187 2.592 . . . . 0.0 113.879 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.377 0 C-N-CA 125.072 1.349 . . . . 0.0 112.075 174.369 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -146.79 34.54 0.93 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.569 1.148 . . . . 0.0 114.015 -168.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.9 t -71.15 146.58 49.06 Favored 'General case' 0 CA--C 1.55 0.947 0 O-C-N 120.972 -1.08 . . . . 0.0 113.778 -172.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -85.27 39.56 0.78 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 -173.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -49.49 -47.28 48.68 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.455 1.502 . . . . 0.0 114.776 -171.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -66.05 -37.09 84.96 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.107 1.322 . . . . 0.0 113.608 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -74.55 -37.93 62.87 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.44 1.096 . . . . 0.0 111.729 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.1 t -63.95 -44.88 91.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.528 1.131 . . . . 0.0 111.876 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -56.38 -35.59 67.9 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.207 1.003 . . . . 0.0 113.332 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.6 tp -71.2 -34.08 70.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 110.877 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -72.43 -41.22 66.43 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.792 -1.192 . . . . 0.0 112.192 172.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.6 m -68.45 -29.71 68.42 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.023 -1.048 . . . . 0.0 111.468 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.43 -37.16 74.81 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.203 1.001 . . . . 0.0 111.381 168.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.4 p -67.49 -17.85 64.84 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.7 mt -107.72 1.66 23.19 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.18 2.192 . . . . 0.0 112.783 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.43 28.37 69.79 Favored Glycine 0 CA--C 1.539 1.578 0 O-C-N 120.82 -1.175 . . . . 0.0 115.833 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -142.41 -178.27 5.67 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 119.109 1.454 . . . . 0.0 112.723 178.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 mt -88.79 148.77 23.75 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.64 1.176 . . . . 0.0 112.083 -173.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -92.34 141.11 15.44 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.187 -0.785 . . . . 0.0 111.984 168.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -148.77 129.95 14.56 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.373 1.069 . . . . 0.0 112.982 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.7 m -84.17 118.78 24.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 112.34 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.1 mm -147.69 125.0 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.938 1.695 . . . . 0.0 109.801 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.05 47.37 13.5 Favored Glycine 0 CA--C 1.534 1.25 0 O-C-N 121.646 -0.659 . . . . 0.0 113.872 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 65.74 6.64 4.02 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.27 2.228 . . . . 0.0 116.486 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -146.2 151.66 37.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.238 1.015 . . . . 0.0 113.012 173.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -79.85 142.19 35.47 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 121.831 -0.543 . . . . 0.0 112.464 172.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -140.14 161.19 38.22 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.776 2.03 . . . . 0.0 109.673 169.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -87.78 154.03 20.88 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.766 -0.584 . . . . 0.0 112.548 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.0 m -139.85 146.2 46.03 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 126.542 1.937 . . . . 0.0 111.437 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -65.93 139.6 57.36 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.724 2.282 . . . . 0.0 112.929 -177.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.229 1.012 . . . . 0.0 111.529 171.009 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 119.657 -0.211 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 52.77 27.06 4.97 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -179.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.4 m -76.18 21.61 0.17 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 -169.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.2 m120 52.35 49.15 21.12 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.706 1.602 . . . . 0.0 110.873 -169.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.73 -36.11 69.35 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -168.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -60.14 -36.58 77.85 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.672 -1.268 . . . . 0.0 113.414 174.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.77 -33.42 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.969 1.308 . . . . 0.0 111.465 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 t -67.44 -47.61 69.67 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.816 0.847 . . . . 0.0 112.21 174.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -60.22 -41.23 92.62 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.824 -1.173 . . . . 0.0 112.049 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -73.69 -30.49 62.91 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.419 1.008 . . . . 0.0 112.661 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 t -60.84 -44.09 97.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -74.63 -33.25 62.52 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.793 -0.567 . . . . 0.0 112.343 176.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -62.35 -30.24 71.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.88 -1.137 . . . . 0.0 111.887 172.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 t -62.85 -33.53 75.44 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 170.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -86.72 -18.93 29.98 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.805 1.242 . . . . 0.0 113.461 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.32 15.62 10.33 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.978 1.751 . . . . 0.0 116.075 173.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -146.96 176.19 10.1 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.526 1.663 . . . . 0.0 114.537 -172.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.53 159.79 33.65 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.328 1.851 . . . . 0.0 111.914 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.61 142.3 13.62 Favored Glycine 0 N--CA 1.474 1.198 0 C-N-CA 124.126 0.87 . . . . 0.0 114.388 -178.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -146.17 160.67 41.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.593 1.557 . . . . 0.0 112.206 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -88.25 137.38 32.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.439 0.696 . . . . 0.0 112.757 171.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.2 mt -71.86 -38.8 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.208 1.803 . . . . 0.0 111.361 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.7 -49.56 0.11 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 126.973 2.225 . . . . 0.0 109.648 -176.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -131.95 -7.88 3.5 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.927 1.291 . . . . 0.0 114.479 169.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -125.59 152.36 45.23 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.062 1.345 . . . . 0.0 113.806 -176.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.1 t -76.43 136.97 39.44 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.565 1.546 . . . . 0.0 114.021 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -133.38 136.41 45.29 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.706 2.402 . . . . 0.0 109.359 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 m -94.86 147.86 22.91 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.24 148.4 51.11 Favored Pre-proline 0 N--CA 1.482 1.137 0 C-N-CA 125.378 1.471 . . . . 0.0 111.996 -176.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -74.04 154.94 47.73 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.879 2.386 . . . . 0.0 113.923 -176.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.333 0 C-N-CA 125.514 1.526 . . . . 0.0 113.037 177.594 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 119.555 -0.26 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -66.15 145.36 55.89 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 172.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 37.5 t -137.59 152.62 49.59 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.032 1.333 . . . . 0.0 112.129 -179.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -74.93 32.66 0.1 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.632 1.573 . . . . 0.0 113.177 174.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.6 tt -56.08 -39.72 72.54 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.982 1.713 . . . . 0.0 112.646 -169.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -63.21 -40.95 98.93 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.233 1.013 . . . . 0.0 112.303 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -74.94 -35.66 62.13 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 118.736 0.698 . . . . 0.0 112.779 173.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.0 m -64.29 -39.93 94.92 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.284 0.493 . . . . 0.0 112.051 175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.83 -34.37 73.0 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.865 -1.147 . . . . 0.0 113.513 176.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 tp -70.74 -44.67 66.33 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.563 1.545 . . . . 0.0 110.12 176.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 t -63.06 -45.07 93.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.738 0.815 . . . . 0.0 112.117 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.5 m -74.28 -27.92 60.96 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.347 -0.846 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 -60.67 -37.51 81.82 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 121.133 -0.979 . . . . 0.0 111.288 167.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.9 m -67.29 -21.74 65.67 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 172.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.8 mt -97.49 -5.26 36.34 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.315 1.446 . . . . 0.0 113.208 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.57 49.02 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.923 1.249 . . . . 0.0 115.924 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.74 168.78 18.89 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 118.938 1.369 . . . . 0.0 113.226 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.9 mt -83.31 143.71 30.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.034 1.334 . . . . 0.0 111.694 -175.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.38 131.9 10.73 Favored Glycine 0 N--CA 1.469 0.834 0 O-C-N 121.537 -0.727 . . . . 0.0 113.278 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -152.98 171.07 18.91 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.792 1.637 . . . . 0.0 111.219 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 64.3 m -122.29 162.03 22.22 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.261 1.424 . . . . 0.0 113.044 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.5 mm -128.16 96.79 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.13 1.772 . . . . 0.0 106.466 168.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.68 -137.93 20.86 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -167.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -76.87 3.19 12.56 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 175.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -121.59 132.23 54.56 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -167.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.4 m -71.18 136.1 47.91 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.587 1.155 . . . . 0.0 113.374 -178.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -150.12 84.08 1.39 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 127.287 2.235 . . . . 0.0 109.886 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -61.62 154.27 25.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.5 m -140.53 156.86 69.19 Favored Pre-proline 0 N--CA 1.488 1.47 0 C-N-CA 126.113 1.765 . . . . 0.0 113.368 -170.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -60.27 147.2 94.56 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 123.803 3.002 . . . . 0.0 116.544 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.228 1.811 . . . . 0.0 113.684 173.77 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -65.13 137.85 57.91 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.471 0.708 . . . . 0.0 112.274 174.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.5 p -156.11 23.33 0.37 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.293 1.437 . . . . 0.0 113.324 -177.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 54.26 23.99 4.7 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.885 2.074 . . . . 0.0 115.108 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.7 tp -59.33 -23.89 62.88 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.644 1.178 . . . . 0.0 113.821 -172.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -53.58 -47.24 70.3 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 120.108 1.322 . . . . 0.0 111.624 172.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -71.89 -37.29 70.16 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.017 1.327 . . . . 0.0 113.581 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.71 -46.77 80.9 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 117.946 0.339 . . . . 0.0 111.02 174.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -58.4 -50.58 73.16 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.109 1.364 . . . . 0.0 112.258 175.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.21 -34.85 77.01 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.658 1.572 . . . . 0.0 112.172 -176.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.4 m -63.06 -39.38 94.56 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.08 0.552 . . . . 0.0 111.471 173.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -81.01 -33.71 33.45 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 178.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -68.33 -29.7 68.51 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.326 -1.484 . . . . 0.0 111.905 176.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.6 m -59.38 -27.34 65.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.076 0.95 . . . . 0.0 112.133 169.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -103.31 4.9 36.98 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.508 1.923 . . . . 0.0 113.322 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.04 30.59 46.27 Favored Glycine 0 CA--C 1.538 1.492 0 N-CA-C 116.843 1.497 . . . . 0.0 116.843 174.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -138.87 157.73 45.51 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 120.207 2.004 . . . . 0.0 114.446 177.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 22.9 tp -83.97 144.54 29.08 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.234 1.813 . . . . 0.0 112.305 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.13 145.55 16.29 Favored Glycine 0 CA--C 1.537 1.435 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -137.07 118.04 14.27 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.741 2.017 . . . . 0.0 110.348 169.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 p -71.33 127.23 31.87 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.096 -1.002 . . . . 0.0 110.136 169.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.0 mm -103.4 -33.9 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.206 1.002 . . . . 0.0 111.883 -169.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.2 -110.87 0.42 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.418 1.485 . . . . 0.0 111.154 -170.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -71.95 -27.43 62.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.012 1.325 . . . . 0.0 113.726 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -141.9 135.34 29.37 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.646 1.978 . . . . 0.0 111.458 178.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.8 t -80.01 149.52 30.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.267 1.427 . . . . 0.0 112.318 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.05 162.92 28.75 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.739 1.615 . . . . 0.0 111.257 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -132.52 151.24 51.98 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.778 0.831 . . . . 0.0 112.915 -175.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.9 m -144.78 162.36 38.86 Favored Pre-proline 0 N--CA 1.48 1.067 0 C-N-CA 126.581 1.952 . . . . 0.0 112.531 -169.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.99 142.37 81.16 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 123.106 2.537 . . . . 0.0 114.808 -175.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.401 1.48 . . . . 0.0 114.833 -176.223 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.889 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -63.09 137.21 58.18 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.1 m -77.85 14.02 1.2 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.509 1.524 . . . . 0.0 114.871 -178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 56.45 30.21 16.66 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 126.515 1.926 . . . . 0.0 113.107 -169.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.03 -29.59 63.5 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -169.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.6 ttp85 -65.15 -45.77 83.63 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.393 1.451 . . . . 0.0 112.003 174.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.78 -40.62 97.88 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.735 0.814 . . . . 0.0 110.525 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.8 t -60.64 -51.72 68.2 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.32 1.448 . . . . 0.0 111.587 175.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.47 -46.78 86.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.37 1.068 . . . . 0.0 113.031 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pp -66.6 -33.53 75.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.941 1.701 . . . . 0.0 111.981 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.5 m -63.85 -46.45 84.95 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.238 0.615 . . . . 0.0 110.981 170.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -77.79 -30.63 51.39 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -61.0 -40.31 93.04 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.111 1.364 . . . . 0.0 110.677 167.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.9 m -67.12 -22.27 65.81 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.797 0.839 . . . . 0.0 113.014 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.72 -14.28 24.93 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.677 1.591 . . . . 0.0 113.782 173.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.79 24.66 24.89 Favored Glycine 0 CA--C 1.542 1.764 0 C-N-CA 125.981 1.753 . . . . 0.0 115.923 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.83 167.87 21.15 Favored 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 119.327 1.564 . . . . 0.0 113.865 -178.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 mt -92.17 136.24 33.35 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.849 1.26 . . . . 0.0 112.76 -170.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.37 149.31 21.84 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.057 0.837 . . . . 0.0 113.839 170.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -153.88 137.84 16.32 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.109 1.763 . . . . 0.0 112.078 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.6 t -83.24 118.18 23.46 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.171 -0.955 . . . . 0.0 110.299 169.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.6 mt -84.17 -35.3 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.824 0.85 . . . . 0.0 110.923 -175.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.8 -68.21 0.13 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.63 1.11 . . . . 0.0 112.67 177.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.69 -24.67 41.58 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.865 -0.786 . . . . 0.0 113.026 175.496 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -159.96 166.1 30.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.699 1.199 . . . . 0.0 112.398 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.1 t -96.19 133.56 40.36 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.673 1.189 . . . . 0.0 112.437 172.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -133.16 170.71 15.02 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.471 2.308 . . . . 0.0 109.05 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -126.54 154.42 43.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.2 m -146.71 152.39 44.74 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 126.615 1.966 . . . . 0.0 111.757 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.65 146.07 97.08 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 122.784 2.323 . . . . 0.0 113.769 176.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.351 0 C-N-CA 125.545 1.538 . . . . 0.0 111.57 169.768 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -81.58 55.53 2.69 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.515 1.926 . . . . 0.0 110.779 176.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -42.25 -43.57 3.48 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.157 2.183 . . . . 0.0 115.206 -169.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -66.51 -39.47 88.68 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 121.637 2.017 . . . . 0.0 113.869 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -59.09 -38.62 79.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.485 1.514 . . . . 0.0 111.395 170.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 57.9 m -67.24 -48.54 67.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.307 0.643 . . . . 0.0 112.447 172.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.53 -39.22 90.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.129 0.972 . . . . 0.0 112.382 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -74.26 -33.74 63.38 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.936 0.789 . . . . 0.0 112.241 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -63.23 -39.48 94.73 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.405 -0.809 . . . . 0.0 111.39 171.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -70.54 -41.56 72.36 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.768 -0.582 . . . . 0.0 111.792 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -57.0 -41.47 78.53 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.393 0.997 . . . . 0.0 111.022 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.1 m -62.25 -27.41 68.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.331 1.052 . . . . 0.0 113.775 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 tp -86.22 -43.82 12.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.653 1.981 . . . . 0.0 110.422 173.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 150.4 4.67 0.21 Allowed Glycine 0 CA--C 1.534 1.243 0 CA-C-O 117.187 -1.896 . . . . 0.0 117.243 169.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -144.37 177.84 8.35 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.925 2.362 . . . . 0.0 114.516 -168.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.32 159.09 32.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.168 0.987 . . . . 0.0 112.713 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.7 155.5 16.27 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.491 1.044 . . . . 0.0 113.579 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -145.61 150.69 36.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.907 1.683 . . . . 0.0 111.818 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.5 m -77.97 154.15 31.82 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.717 -0.615 . . . . 0.0 111.034 168.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.1 mm -113.33 -37.91 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.982 1.713 . . . . 0.0 110.171 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.77 -111.27 0.39 Allowed Glycine 0 N--CA 1.463 0.47 0 N-CA-C 108.686 -1.765 . . . . 0.0 108.686 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.74 2.73 9.34 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.956 0.902 . . . . 0.0 113.364 168.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -136.52 158.74 43.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.352 2.261 . . . . 0.0 110.425 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.1 p -130.19 152.27 49.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.448 1.499 . . . . 0.0 112.276 173.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -137.91 167.77 21.08 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.53 1.532 . . . . 0.0 112.53 -174.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -109.22 148.76 30.43 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.9 m -144.4 152.64 54.11 Favored Pre-proline 0 N--CA 1.48 1.038 0 C-N-CA 125.636 1.574 . . . . 0.0 113.018 -172.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -61.48 158.7 35.05 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.899 3.066 . . . . 0.0 116.153 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.472 0 C-N-CA 127.163 2.185 . . . . 0.0 115.14 176.838 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 118.543 2.794 . . . . 0.0 118.543 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 57.11 32.64 22.03 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-N 119.759 1.163 . . . . 0.0 111.748 -166.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.62 -37.27 79.62 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.926 1.69 . . . . 0.0 112.768 -173.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -43.24 78.75 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.514 1.052 . . . . 0.0 110.013 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 54.5 mtt85 -69.89 -36.74 75.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.57 1.548 . . . . 0.0 112.449 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.2 t -65.43 -53.02 49.0 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.533 0.683 . . . . 0.0 111.128 173.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -23.63 59.32 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.031 -1.043 . . . . 0.0 113.365 -172.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.1 tp -59.04 -46.97 86.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.965 1.706 . . . . 0.0 110.905 168.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 t -61.3 -34.24 74.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.684 0.793 . . . . 0.0 111.751 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.98 -41.91 58.6 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.79 1.236 . . . . 0.0 112.657 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -63.79 -31.04 72.09 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.198 1.399 . . . . 0.0 112.158 175.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.0 m -62.81 -4.68 2.24 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.775 1.23 . . . . 0.0 113.647 167.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -122.38 -4.1 8.88 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.175 2.19 . . . . 0.0 112.854 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.43 -6.43 71.33 Favored Glycine 0 CA--C 1.542 1.746 0 C-N-CA 126.777 2.132 . . . . 0.0 116.242 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.83 157.1 35.58 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.912 2.085 . . . . 0.0 112.922 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.1 mt -110.81 151.82 27.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.507 1.523 . . . . 0.0 109.623 169.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.33 157.06 17.0 Favored Glycine 0 N--CA 1.476 1.327 0 CA-C-N 119.349 0.977 . . . . 0.0 114.508 -178.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -146.74 144.74 29.62 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.855 1.662 . . . . 0.0 112.374 173.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.76 122.95 26.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.103 0.561 . . . . 0.0 110.879 171.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.9 mm -81.16 -22.6 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.586 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.48 -68.16 0.5 Allowed Glycine 0 CA--C 1.524 0.651 0 C-N-CA 126.637 2.065 . . . . 0.0 110.685 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -87.58 -19.42 27.84 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.052 1.741 . . . . 0.0 113.083 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -137.17 162.2 34.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.558 1.943 . . . . 0.0 111.425 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.12 151.24 21.19 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.033 1.333 . . . . 0.0 110.046 168.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -138.63 146.86 42.21 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.333 1.053 . . . . 0.0 110.706 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -115.38 154.97 28.24 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.51 1.124 . . . . 0.0 113.221 173.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.6 m -143.46 155.88 60.59 Favored Pre-proline 0 N--CA 1.471 0.603 0 C-N-CA 126.654 1.982 . . . . 0.0 110.775 -173.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -66.09 156.63 63.73 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.551 2.167 . . . . 0.0 113.289 173.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.218 0 C-N-CA 125.218 1.407 . . . . 0.0 113.199 179.774 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.7 p . . . . . 0 CA--C 1.549 0.942 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.255 4.5 m-80 57.94 23.65 10.1 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.479 2.312 . . . . 0.0 115.907 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -50.93 -37.02 41.63 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.287 1.035 . . . . 0.0 112.708 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -58.22 -33.22 69.08 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -175.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -97.73 -30.24 12.92 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.476 1.035 . . . . 0.0 112.492 172.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -57.01 -48.08 79.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.103 0.961 . . . . 0.0 112.288 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -53.83 -42.11 68.12 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.309 1.044 . . . . 0.0 112.319 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.54 -44.68 70.46 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.248 2.219 . . . . 0.0 111.445 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 t -71.26 -34.7 70.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.783 1.233 . . . . 0.0 112.617 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 57.6 m -71.59 -27.44 63.13 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.487 -0.758 . . . . 0.0 111.608 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -56.64 -31.83 64.73 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.618 1.167 . . . . 0.0 112.212 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.8 t -62.28 -22.58 66.12 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.82 1.248 . . . . 0.0 113.878 174.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.2 mt -105.65 -7.35 18.54 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.934 1.694 . . . . 0.0 113.124 173.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.0 21.35 25.78 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.516 1.531 . . . . 0.0 116.171 173.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.9 167.21 22.52 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.008 1.404 . . . . 0.0 113.278 -177.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.6 mt -79.33 167.59 20.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.453 1.501 . . . . 0.0 112.178 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.51 137.29 14.14 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.859 1.218 . . . . 0.0 111.969 169.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -132.72 138.01 47.09 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.353 1.461 . . . . 0.0 110.735 176.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 89.5 m -70.49 124.88 25.28 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 171.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -110.51 78.68 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 127.37 2.268 . . . . 0.0 106.805 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.42 -124.38 7.18 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 125.932 1.73 . . . . 0.0 112.415 -172.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -74.57 3.18 8.13 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.498 2.319 . . . . 0.0 114.788 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -151.15 136.25 17.5 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.523 1.129 . . . . 0.0 111.674 -166.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -95.24 138.59 32.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.538 0.735 . . . . 0.0 112.711 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -132.19 156.28 46.72 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.494 2.318 . . . . 0.0 110.644 -177.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.4 m -82.67 137.28 34.51 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.591 -0.693 . . . . 0.0 112.399 -175.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 m -136.38 145.27 51.05 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 125.132 1.373 . . . . 0.0 112.776 -173.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.66 151.49 83.34 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.248 2.632 . . . . 0.0 113.752 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.134 1.374 . . . . 0.0 113.752 174.908 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.7 m . . . . . 0 CA--C 1.536 0.439 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -83.82 55.05 3.1 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.615 1.166 . . . . 0.0 108.879 170.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 19.3 tp -52.45 -33.1 42.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.703 1.601 . . . . 0.0 115.169 -168.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 66.1 ttp85 -62.73 -48.97 76.9 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.768 1.622 . . . . 0.0 112.571 173.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -65.87 -29.6 70.08 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.603 0.761 . . . . 0.0 112.198 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.5 m -68.84 -51.09 44.29 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.672 0.789 . . . . 0.0 110.88 169.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -60.06 -43.3 95.53 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.165 0.986 . . . . 0.0 112.301 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 pp -69.55 -34.66 74.51 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.003 0.82 . . . . 0.0 111.989 -178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -63.73 -47.35 81.42 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.873 0.869 . . . . 0.0 111.1 171.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.79 -37.23 62.43 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 118.118 0.417 . . . . 0.0 112.089 -176.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -61.33 -33.71 74.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.802 1.241 . . . . 0.0 111.738 173.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 m -67.65 -2.45 6.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 171.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.0 mt -124.08 9.96 8.73 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.268 2.227 . . . . 0.0 112.476 172.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.64 -4.86 62.95 Favored Glycine 0 CA--C 1.541 1.689 0 N-CA-C 116.159 1.224 . . . . 0.0 116.159 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.16 171.12 11.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.347 2.259 . . . . 0.0 113.174 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -123.53 137.05 54.85 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.338 1.855 . . . . 0.0 108.738 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.13 136.31 13.47 Favored Glycine 0 N--CA 1.468 0.82 0 C-N-CA 125.534 1.54 . . . . 0.0 114.583 -176.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -134.42 140.93 46.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.493 1.917 . . . . 0.0 110.881 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.5 t -76.37 140.17 41.29 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.195 -0.941 . . . . 0.0 111.728 169.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.8 mt -85.02 -58.27 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.127 0.971 . . . . 0.0 109.729 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -168.09 -49.37 0.03 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.863 1.697 . . . . 0.0 112.073 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.82 -11.94 6.57 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.623 1.569 . . . . 0.0 113.753 170.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -115.63 149.38 38.4 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.853 1.661 . . . . 0.0 113.181 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.1 m -83.93 147.9 27.23 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.416 1.086 . . . . 0.0 111.951 167.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -131.4 130.09 42.14 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.587 1.955 . . . . 0.0 109.245 170.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.6 m -119.71 136.99 54.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.272 0.629 . . . . 0.0 112.359 177.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -137.95 161.99 56.66 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.846 1.658 . . . . 0.0 110.379 -173.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.83 156.75 41.65 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.388 2.059 . . . . 0.0 113.052 172.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.32 175.329 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -78.49 40.42 0.37 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.338 1.455 . . . . 0.0 111.211 169.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 15.3 tp -57.15 -31.61 65.54 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.117 1.367 . . . . 0.0 114.331 -167.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -58.85 -35.44 72.93 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.466 1.106 . . . . 0.0 113.124 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -81.79 -35.93 28.98 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.14 1.376 . . . . 0.0 111.642 173.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -61.86 -45.78 92.32 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.164 0.586 . . . . 0.0 112.063 178.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -56.57 -45.91 81.04 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.853 -0.529 . . . . 0.0 111.856 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -70.08 -39.25 75.71 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.868 2.067 . . . . 0.0 111.591 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.3 m -60.44 -46.19 90.95 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.247 1.019 . . . . 0.0 110.868 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.5 m -78.0 -29.66 49.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.527 0.731 . . . . 0.0 112.216 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.66 -38.26 89.63 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 120.375 -1.453 . . . . 0.0 111.255 170.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.5 m -70.01 -14.07 62.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.771 1.229 . . . . 0.0 114.103 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -103.26 -14.95 16.13 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.082 1.353 . . . . 0.0 113.159 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.18 37.28 6.32 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.471 1.51 . . . . 0.0 115.286 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -150.94 163.6 38.31 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 118.976 1.388 . . . . 0.0 113.301 175.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.0 mp -90.6 158.43 16.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.269 1.828 . . . . 0.0 111.883 -172.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.87 154.25 16.47 Favored Glycine 0 N--CA 1.478 1.49 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -151.16 140.22 21.11 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.129 1.772 . . . . 0.0 113.244 173.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.8 t -75.51 138.84 41.82 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 120.787 -1.196 . . . . 0.0 111.992 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.3 mt -142.25 103.33 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 122.33 1.062 . . . . 0.0 112.074 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 -60.16 2.84 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 127.942 2.687 . . . . 0.0 114.582 168.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.26 5.6 0.64 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -159.7 154.62 24.68 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.073 0.851 . . . . 0.0 110.968 -178.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.98 146.64 27.89 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.292 -0.88 . . . . 0.0 112.695 177.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -128.63 158.41 38.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.7 1.6 . . . . 0.0 109.86 171.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 88.2 m -119.16 153.71 34.45 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.734 0.778 . . . . 0.0 112.63 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 m -140.73 151.48 63.23 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 126.287 1.835 . . . . 0.0 111.837 -168.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -65.44 155.98 65.89 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.902 2.401 . . . . 0.0 116.648 -168.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.385 0 C-N-CA 126.824 2.05 . . . . 0.0 114.298 174.919 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.9 t . . . . . 0 CA--C 1.537 0.475 0 CA-C-O 121.38 0.609 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -71.58 34.75 0.06 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.302 1.841 . . . . 0.0 112.524 169.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -49.16 -46.7 45.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.686 1.994 . . . . 0.0 113.737 -167.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -67.9 -37.38 81.65 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -64.25 -42.57 96.45 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.312 1.445 . . . . 0.0 110.988 169.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.0 m -66.03 -43.14 88.49 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.221 0.608 . . . . 0.0 111.888 179.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -62.78 -35.41 79.75 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.884 -1.135 . . . . 0.0 112.58 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 tp -69.67 -37.54 76.73 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.791 1.636 . . . . 0.0 111.027 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.4 t -65.25 -44.51 87.9 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.074 -1.016 . . . . 0.0 111.33 173.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.9 m -70.65 -26.59 63.53 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.143 -0.973 . . . . 0.0 112.222 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -60.63 -24.71 65.75 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.043 -1.036 . . . . 0.0 112.396 170.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.3 p -63.38 -38.9 92.92 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.466 1.03 . . . . 0.0 112.848 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.4 mt -98.39 12.5 34.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.377 1.471 . . . . 0.0 113.045 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.49 22.11 56.99 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.725 1.45 . . . . 0.0 116.725 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.11 -174.56 3.58 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.211 1.506 . . . . 0.0 113.844 -175.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -97.76 156.45 16.56 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.673 1.589 . . . . 0.0 111.905 -174.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.04 150.67 17.14 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 124.723 1.154 . . . . 0.0 114.329 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -137.93 149.47 46.21 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.016 2.126 . . . . 0.0 112.159 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.2 m -91.05 145.5 24.64 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.789 1.236 . . . . 0.0 112.632 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.7 mm -139.83 74.78 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.573 1.549 . . . . 0.0 108.715 169.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.02 -120.06 8.39 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.225 1.393 . . . . 0.0 112.974 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -75.09 -5.53 44.71 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.474 -1.015 . . . . 0.0 113.425 172.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -120.13 177.9 4.83 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.894 1.678 . . . . 0.0 111.717 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 30.1 m -136.09 162.47 32.81 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 125.073 1.349 . . . . 0.0 112.591 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -136.01 175.73 9.33 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.357 2.263 . . . . 0.0 110.767 171.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.4 m -116.14 164.38 14.56 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.581 0.752 . . . . 0.0 110.59 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -142.12 149.21 51.37 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.947 1.699 . . . . 0.0 110.348 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.1 139.58 85.54 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.688 2.259 . . . . 0.0 112.018 177.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.293 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -176.643 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.2 t . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -81.02 54.3 2.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.574 1.549 . . . . 0.0 110.985 168.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.4 tt -47.83 -39.22 17.79 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.939 2.096 . . . . 0.0 112.891 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -59.81 -40.27 87.82 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.705 1.202 . . . . 0.0 113.573 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -71.0 -36.39 72.45 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.078 1.751 . . . . 0.0 111.657 172.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.4 m -66.33 -43.28 86.6 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.191 0.905 . . . . 0.0 112.8 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 49.4 mt-10 -62.26 -38.47 89.4 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.035 -1.04 . . . . 0.0 112.547 176.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.5 -42.51 87.27 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.02 1.728 . . . . 0.0 110.347 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -59.84 -47.91 83.84 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.361 1.065 . . . . 0.0 111.592 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.0 m -74.04 -21.16 60.06 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.958 -1.089 . . . . 0.0 112.931 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -61.76 -22.05 65.07 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.921 -1.112 . . . . 0.0 112.549 169.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 p -74.55 -28.4 60.93 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 170.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.2 mt -90.84 -15.72 29.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.675 1.99 . . . . 0.0 113.319 177.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.13 18.11 11.77 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.527 1.537 . . . . 0.0 116.053 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -155.12 -178.12 7.02 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 119.743 1.772 . . . . 0.0 113.26 -173.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.58 167.19 21.63 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.219 1.408 . . . . 0.0 111.264 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.405 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -142.98 146.04 16.5 Favored Glycine 0 N--CA 1.473 1.145 0 O-C-N 121.029 -1.044 . . . . 0.0 114.915 -174.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -147.24 152.6 38.59 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.962 2.105 . . . . 0.0 110.393 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.8 m -77.74 131.8 37.83 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.123 -0.986 . . . . 0.0 112.301 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.8 mm -130.18 87.1 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-O 122.866 1.317 . . . . 0.0 108.674 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.13 -143.79 31.26 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 113.85 -1.523 . . . . 0.0 112.383 -170.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -74.83 21.74 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -155.83 149.36 24.92 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.665 -1.272 . . . . 0.0 112.304 -175.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.7 m -79.95 135.26 36.36 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 113.297 175.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -117.77 158.96 23.83 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.655 1.982 . . . . 0.0 110.032 167.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.4 m -113.87 149.03 35.68 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -169.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.8 m -135.11 153.06 78.1 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 125.794 1.637 . . . . 0.0 112.041 -170.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -67.77 151.11 79.08 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.813 2.342 . . . . 0.0 115.683 -169.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.607 1.563 . . . . 0.0 113.882 171.501 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.3 t . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -81.28 49.76 1.33 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.549 1.939 . . . . 0.0 112.036 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.4 tp -61.81 -40.77 96.41 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -172.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -66.48 -33.43 75.67 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.1 1.318 . . . . 0.0 112.061 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -73.64 -38.64 64.95 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.908 0.883 . . . . 0.0 112.224 168.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -59.17 -42.22 90.29 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.024 0.829 . . . . 0.0 111.563 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.38 -47.52 78.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.168 0.987 . . . . 0.0 112.632 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.3 tp -73.06 -29.99 63.37 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.862 1.665 . . . . 0.0 112.119 -177.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.0 t -63.94 -36.87 85.37 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.433 1.093 . . . . 0.0 111.649 169.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.47 -30.93 33.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.273 -0.892 . . . . 0.0 113.008 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -52.26 -36.63 53.15 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.003 0.921 . . . . 0.0 111.57 169.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 p -57.44 -28.63 63.5 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.4 mt -104.38 5.47 34.4 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.56 1.944 . . . . 0.0 113.698 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.14 12.42 67.98 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.57 178.24 7.15 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.594 1.697 . . . . 0.0 112.608 -177.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.0 mt -83.03 160.33 21.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.588 1.155 . . . . 0.0 111.906 -176.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.9 153.0 17.57 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 123.83 0.729 . . . . 0.0 112.672 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -149.88 132.07 15.44 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.87 0.868 . . . . 0.0 111.679 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.5 t -86.18 124.77 32.95 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.79 0.436 . . . . 0.0 110.611 169.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.19 33.82 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.811 1.644 . . . . 0.0 110.553 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.34 -64.5 1.36 Allowed Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.769 1.652 . . . . 0.0 113.317 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -74.83 -33.87 62.23 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.276 1.43 . . . . 0.0 113.504 -176.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -158.79 155.3 27.66 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.466 1.106 . . . . 0.0 112.593 -168.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -83.69 143.93 29.72 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.604 1.162 . . . . 0.0 111.355 169.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -151.09 161.08 43.4 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.185 1.394 . . . . 0.0 111.959 167.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 m -94.7 150.42 20.24 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -141.97 148.48 48.98 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 125.774 1.63 . . . . 0.0 111.136 -173.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -65.61 138.07 52.79 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.203 2.602 . . . . 0.0 113.965 -172.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.073 1.749 . . . . 0.0 113.746 179.561 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.7 p . . . . . 0 CA--C 1.543 0.704 0 CA-C-O 122.278 1.037 . . . . 0.0 113.485 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -79.1 49.85 0.99 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 128.312 2.645 . . . . 0.0 111.612 177.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -47.48 -37.82 12.58 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.972 1.309 . . . . 0.0 113.445 -170.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -57.46 -45.06 85.19 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.175 0.99 . . . . 0.0 113.63 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.13 -37.26 66.72 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.173 1.789 . . . . 0.0 110.889 173.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 64.2 m -60.48 -43.37 97.05 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.413 0.685 . . . . 0.0 112.826 175.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -56.27 -47.04 79.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.534 1.061 . . . . 0.0 110.947 172.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tp -63.21 -39.53 94.88 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.566 1.546 . . . . 0.0 111.503 177.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 m -63.06 -37.82 88.73 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.503 1.521 . . . . 0.0 113.186 171.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 64.5 m -78.08 -34.92 49.98 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.627 -0.671 . . . . 0.0 111.904 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -30.53 71.36 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.857 -1.152 . . . . 0.0 111.762 176.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.7 t -63.24 -41.64 99.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 0.0 111.676 168.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.15 -6.41 54.69 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.151 1.38 . . . . 0.0 113.662 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.54 13.15 56.09 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 125.981 1.753 . . . . 0.0 115.79 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -141.63 171.86 13.48 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.898 1.349 . . . . 0.0 113.404 -175.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.4 mt -75.07 151.09 38.69 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 112.289 -173.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.34 136.88 12.94 Favored Glycine 0 N--CA 1.471 0.98 0 O-C-N 121.409 -0.807 . . . . 0.0 112.864 173.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -143.55 166.93 23.46 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.848 1.659 . . . . 0.0 110.874 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 t -150.07 153.43 36.42 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -173.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -129.48 103.07 8.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 126.349 1.859 . . . . 0.0 107.53 167.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.03 -102.3 0.34 Allowed Glycine 0 CA--C 1.534 1.278 0 C-N-CA 127.087 2.28 . . . . 0.0 114.533 176.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.03 10.48 28.88 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.816 2.047 . . . . 0.0 113.034 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -143.15 115.6 8.55 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.138 -1.601 . . . . 0.0 113.677 -173.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.2 m -84.6 138.91 32.45 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.66 1.584 . . . . 0.0 112.311 169.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.17 135.88 26.0 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.354 1.462 . . . . 0.0 110.495 169.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 m -78.32 153.43 31.73 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.9 m -141.82 148.95 51.43 Favored Pre-proline 0 N--CA 1.478 0.942 0 C-N-CA 124.856 1.263 . . . . 0.0 112.054 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_exo -67.67 161.74 42.38 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.658 2.239 . . . . 0.0 112.961 170.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.258 1.533 0 C-N-CA 124.748 1.219 . . . . 0.0 112.765 174.179 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.8 p . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.9 m120 51.73 32.92 10.12 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 127.511 2.324 . . . . 0.0 114.897 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.7 -31.0 24.3 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 -168.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -59.02 -40.19 84.24 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.12 1.327 . . . . 0.0 112.245 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 mmm180 -70.34 -39.78 74.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.469 1.107 . . . . 0.0 111.569 174.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.3 m -67.62 -43.7 79.77 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.269 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.42 -34.72 78.85 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.196 -0.94 . . . . 0.0 113.194 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tp -66.93 -36.69 82.8 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 110.393 171.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.9 m -66.88 -42.44 85.56 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.463 -0.773 . . . . 0.0 111.397 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.96 -36.86 75.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.879 0.763 . . . . 0.0 111.669 175.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -54.65 -40.71 69.28 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.995 -1.065 . . . . 0.0 111.163 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.1 m -75.01 3.27 8.66 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.885 1.674 . . . . 0.0 114.693 176.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -123.9 2.47 8.74 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.008 2.123 . . . . 0.0 112.271 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.35 19.53 66.41 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 125.387 1.47 . . . . 0.0 115.884 177.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -139.9 173.32 11.64 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.81 1.805 . . . . 0.0 112.747 -177.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.6 mt -86.58 176.74 7.65 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.164 1.386 . . . . 0.0 111.553 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -154.46 153.92 25.15 Favored Glycine 0 N--CA 1.474 1.171 0 O-C-N 120.902 -1.124 . . . . 0.0 115.128 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -141.32 147.43 38.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.446 1.498 . . . . 0.0 112.226 -174.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.1 t -81.64 133.85 35.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.747 0.819 . . . . 0.0 112.178 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.0 mt -122.32 65.08 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 127.075 2.15 . . . . 0.0 108.877 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.95 -69.73 0.78 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 127.209 2.337 . . . . 0.0 115.016 176.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -100.74 -18.03 16.67 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.031 1.332 . . . . 0.0 112.954 -174.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -146.52 176.32 9.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 126.371 1.868 . . . . 0.0 112.143 -169.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 29.6 p -126.82 142.68 51.48 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.896 1.278 . . . . 0.0 111.396 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -135.6 150.73 49.76 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.151 0.98 . . . . 0.0 111.853 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 m -79.55 155.03 28.38 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 169.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -143.51 151.0 53.1 Favored Pre-proline 0 N--CA 1.476 0.852 0 C-N-CA 126.206 1.803 . . . . 0.0 111.039 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -59.2 146.7 93.68 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.192 2.595 . . . . 0.0 114.954 -173.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.966 1.706 . . . . 0.0 112.487 173.41 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.42 45.53 0.67 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.54 1.536 . . . . 0.0 111.14 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.48 -38.49 44.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.463 2.305 . . . . 0.0 113.063 -168.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -64.31 -35.35 80.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.313 -0.867 . . . . 0.0 112.773 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -85.56 -32.15 22.29 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.359 1.464 . . . . 0.0 113.545 171.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -68.46 -35.46 77.59 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.089 0.859 . . . . 0.0 112.354 176.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.23 -36.47 66.05 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.194 -1.566 . . . . 0.0 111.954 169.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.4 tp -82.05 -37.78 25.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.06 1.744 . . . . 0.0 111.37 -177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 83.6 p -65.0 -41.81 95.06 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.474 1.033 . . . . 0.0 111.179 175.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.25 -41.92 84.81 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.008 -0.432 . . . . 0.0 110.425 174.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -61.86 -33.35 74.03 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.811 -1.181 . . . . 0.0 112.402 176.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 41.7 t -66.4 -29.35 69.48 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.064 0.946 . . . . 0.0 112.658 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.79 -48.04 17.51 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.92 -1.112 . . . . 0.0 111.126 170.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 144.65 15.71 0.22 Allowed Glycine 0 CA--C 1.537 1.453 0 CA-C-O 117.82 -1.544 . . . . 0.0 116.098 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.94 179.53 7.41 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 120.202 2.001 . . . . 0.0 113.132 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.3 mt -88.46 160.05 17.7 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.851 -1.155 . . . . 0.0 112.844 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.26 138.7 15.14 Favored Glycine 0 N--CA 1.469 0.881 0 C-N-CA 124.295 0.95 . . . . 0.0 113.801 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -141.7 171.25 14.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.354 2.261 . . . . 0.0 109.826 172.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.0 t -150.06 139.01 20.99 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 -174.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.8 mm -117.91 115.41 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.468 1.907 . . . . 0.0 110.57 -174.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -87.03 0.18 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 126.139 1.828 . . . . 0.0 111.676 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 50.0 mp0 -129.42 5.23 5.18 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.17 1.788 . . . . 0.0 112.71 172.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -115.77 117.17 29.49 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.169 0.988 . . . . 0.0 113.163 -168.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.0 m -74.36 138.98 43.78 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 120.569 -1.332 . . . . 0.0 113.153 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -147.13 127.22 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.793 1.637 . . . . 0.0 111.285 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.8 m -77.65 147.69 35.42 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -130.18 148.29 69.15 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 126.532 1.933 . . . . 0.0 110.64 -175.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -65.26 145.29 83.51 Favored 'Trans proline' 0 C--O 1.239 0.547 0 C-N-CA 122.44 2.094 . . . . 0.0 112.901 -171.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 C-N-CA 125.493 1.517 . . . . 0.0 111.158 177.138 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.5 t . . . . . 0 CA--C 1.552 1.035 0 CA-C-O 121.065 0.46 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -111.65 66.5 0.63 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.196 1.798 . . . . 0.0 111.401 -168.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.56 -42.08 15.32 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.207 1.803 . . . . 0.0 114.073 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -65.43 -34.04 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 120.24 -1.538 . . . . 0.0 113.519 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -73.1 -38.14 66.48 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.955 0.902 . . . . 0.0 111.29 172.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.7 t -62.65 -40.84 98.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.473 1.109 . . . . 0.0 112.098 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -58.25 -41.54 84.46 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.864 1.265 . . . . 0.0 112.446 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.2 tp -69.71 -42.71 73.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.377 0.989 . . . . 0.0 110.125 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.9 t -57.82 -39.02 76.62 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.788 -0.57 . . . . 0.0 112.485 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.4 m -79.67 -32.92 41.55 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.474 -0.766 . . . . 0.0 112.975 175.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -60.49 -29.65 69.21 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.644 -1.285 . . . . 0.0 112.539 170.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.6 p -67.64 -14.47 62.97 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 172.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -103.24 -24.71 13.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.151 1.78 . . . . 0.0 112.502 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.01 2.14 28.38 Favored Glycine 0 CA--C 1.542 1.759 0 C-N-CA 125.905 1.717 . . . . 0.0 116.076 174.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.449 ' H ' HD23 ' A' ' 17' ' ' LEU . 1.8 pt? -121.24 171.96 8.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.983 1.713 . . . . 0.0 112.347 -178.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -73.74 154.31 39.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.952 1.301 . . . . 0.0 112.117 -173.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.95 141.89 15.61 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 123.933 0.778 . . . . 0.0 113.938 175.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -138.2 153.39 49.16 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.602 1.561 . . . . 0.0 111.729 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 m -100.19 95.28 6.71 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.247 1.419 . . . . 0.0 110.183 172.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -82.86 68.65 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-O 123.204 1.478 . . . . 0.0 110.146 -176.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.84 -92.33 0.19 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 127.083 2.278 . . . . 0.0 111.879 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -66.78 -28.61 68.53 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 -177.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -155.96 168.06 28.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.75 1.613 . . . . 0.0 114.739 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 t -70.92 132.8 45.77 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.932 0.893 . . . . 0.0 112.712 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -140.07 139.24 35.86 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.15 1.38 . . . . 0.0 110.12 168.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.6 m -87.19 152.69 22.1 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.825 -0.547 . . . . 0.0 112.24 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -138.79 151.8 69.25 Favored Pre-proline 0 N--CA 1.48 1.03 0 C-N-CA 125.088 1.355 . . . . 0.0 111.848 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -65.23 130.5 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 122.713 2.275 . . . . 0.0 111.293 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.404 0 C-N-CA 124.807 1.243 . . . . 0.0 113.417 -174.635 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.3 p . . . . . 0 CA--C 1.551 0.982 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -84.93 44.2 1.05 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.543 1.937 . . . . 0.0 112.754 -176.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.97 -39.61 90.52 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.36 1.464 . . . . 0.0 113.062 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -44.51 68.91 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.244 1.418 . . . . 0.0 110.865 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -69.28 -38.06 78.18 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.978 1.711 . . . . 0.0 112.97 172.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.75 -41.43 97.66 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.502 0.592 . . . . 0.0 112.478 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -63.06 -34.74 78.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.22 -0.925 . . . . 0.0 112.288 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -45.29 65.49 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.738 2.415 . . . . 0.0 110.839 174.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.0 t -58.4 -48.95 79.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.568 1.147 . . . . 0.0 111.509 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -70.88 -31.94 68.75 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.381 -0.824 . . . . 0.0 111.871 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -60.89 -24.79 66.24 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.618 -1.301 . . . . 0.0 113.244 169.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 p -61.84 -28.91 69.82 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.279 1.399 . . . . 0.0 112.326 173.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.06 -2.5 27.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.222 2.209 . . . . 0.0 113.404 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.63 30.83 20.32 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 174.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.5 171.87 13.46 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 119.812 1.806 . . . . 0.0 113.73 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.3 mt -79.25 170.96 15.85 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.977 1.711 . . . . 0.0 112.291 -175.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.99 146.58 17.94 Favored Glycine 0 CA--C 1.537 1.411 0 N-CA-C 115.401 0.92 . . . . 0.0 115.401 -175.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -140.6 156.33 46.31 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.593 2.357 . . . . 0.0 111.508 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.1 p -110.05 55.4 0.64 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.108 1.363 . . . . 0.0 112.512 174.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.9 mm -55.49 -47.6 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.297 1.439 . . . . 0.0 113.446 -168.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -107.9 41.66 2.15 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.652 1.596 . . . . 0.0 112.257 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 64.21 -33.4 0.14 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 127.37 2.268 . . . . 0.0 114.837 -169.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -79.59 150.78 30.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.951 1.701 . . . . 0.0 112.096 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -65.16 131.68 47.17 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -176.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -129.14 128.5 43.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.255 2.222 . . . . 0.0 109.099 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 27.9 m -85.1 147.52 26.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 174.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.3 m -137.07 149.3 65.88 Favored Pre-proline 0 N--CA 1.479 1.011 0 C-N-CA 124.912 1.285 . . . . 0.0 112.107 -170.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.04 137.72 38.29 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 123.297 2.665 . . . . 0.0 114.404 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 C-N-CA 126.574 1.95 . . . . 0.0 113.114 -178.971 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.3 m . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.41 36.62 0.43 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.507 1.923 . . . . 0.0 112.492 174.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mt -55.87 -48.01 76.34 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.021 1.328 . . . . 0.0 113.453 -170.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.7 ttp85 -63.8 -34.81 78.74 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.656 -1.278 . . . . 0.0 111.341 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -72.08 -34.31 68.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 126.883 2.073 . . . . 0.0 113.906 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.91 -40.38 28.35 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.782 0.719 . . . . 0.0 112.127 175.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -53.39 -35.07 59.96 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.63 1.572 . . . . 0.0 112.974 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.32 -31.6 72.49 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.591 1.087 . . . . 0.0 112.994 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.0 t -77.6 -39.33 45.9 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.409 1.084 . . . . 0.0 111.07 171.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.9 m -66.3 -38.64 88.22 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.084 -1.01 . . . . 0.0 111.372 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -43.48 89.82 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.52 1.128 . . . . 0.0 111.196 170.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -59.3 -32.89 70.46 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.484 0.714 . . . . 0.0 112.872 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 97.0 mt -91.17 -4.8 55.8 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.006 1.722 . . . . 0.0 113.632 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 29.88 57.74 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.711 1.624 . . . . 0.0 115.907 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.31 178.43 7.42 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 118.42 1.11 . . . . 0.0 112.489 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -91.58 147.62 22.87 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.975 -1.078 . . . . 0.0 112.415 -169.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -88.77 137.39 14.22 Favored Glycine 0 CA--C 1.533 1.167 0 O-C-N 121.462 -0.773 . . . . 0.0 112.368 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -145.26 137.02 25.47 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.701 1.2 . . . . 0.0 111.023 176.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -81.67 73.68 8.7 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.415 -0.803 . . . . 0.0 110.901 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 pt -64.12 -17.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -170.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.17 115.84 0.34 Allowed Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.458 1.028 . . . . 0.0 111.908 169.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 61.99 -35.74 0.11 Allowed 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 128.951 2.9 . . . . 0.0 115.889 -172.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -139.17 158.01 44.93 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 127.556 2.342 . . . . 0.0 110.644 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -87.21 140.79 29.19 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.033 1.123 . . . . 0.0 114.033 -178.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -134.44 156.67 48.15 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.996 1.719 . . . . 0.0 108.982 168.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 5.6 m -85.05 144.71 28.08 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.054 -0.404 . . . . 0.0 111.436 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.7 m -135.93 148.19 64.02 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 125.81 1.644 . . . . 0.0 111.016 -173.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.16 151.67 72.48 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.661 2.241 . . . . 0.0 111.382 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.337 0 C-N-CA 125.19 1.396 . . . . 0.0 112.073 174.989 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.3 t . . . . . 0 CA--C 1.549 0.923 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 m120 56.65 47.51 18.24 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.415 2.286 . . . . 0.0 111.654 -169.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.0 tt -53.86 -34.64 59.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.461 1.504 . . . . 0.0 113.193 -174.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.8 ttp180 -69.06 -32.85 72.61 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.762 0.825 . . . . 0.0 112.287 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -69.64 -43.69 72.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.655 1.182 . . . . 0.0 110.432 170.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -58.34 -49.26 77.85 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.864 176.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.11 -41.92 84.62 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.889 0.876 . . . . 0.0 113.191 174.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.72 -39.88 95.39 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.953 1.301 . . . . 0.0 110.802 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 p -59.88 -36.73 77.55 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.605 -0.684 . . . . 0.0 112.253 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.4 m -85.6 -37.01 20.01 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.99 0.916 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -56.8 -39.61 74.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.883 1.673 . . . . 0.0 112.067 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 m -62.36 -23.15 66.64 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.186 0.994 . . . . 0.0 113.108 175.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.7 mt -103.79 7.05 37.08 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 127.649 2.38 . . . . 0.0 113.714 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.5 23.07 61.14 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 125.099 1.333 . . . . 0.0 116.287 174.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.84 176.76 9.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.749 1.775 . . . . 0.0 113.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.8 mt -91.23 151.98 20.7 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.802 0.841 . . . . 0.0 112.537 -169.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.96 142.82 16.19 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.285 0.945 . . . . 0.0 114.314 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -134.57 114.36 12.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.324 1.45 . . . . 0.0 109.321 177.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -105.88 117.43 34.02 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.229 1.012 . . . . 0.0 110.719 -171.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -83.06 -45.7 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 124.354 1.061 . . . . 0.0 111.142 -170.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.57 107.0 0.79 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 126.442 1.973 . . . . 0.0 109.078 -169.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 60.68 4.99 0.83 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.055 1.742 . . . . 0.0 115.606 -167.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -149.8 147.32 27.86 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.446 1.498 . . . . 0.0 112.351 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.5 t -127.27 143.76 51.18 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.387 1.875 . . . . 0.0 110.833 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -136.07 159.11 42.73 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.674 1.99 . . . . 0.0 109.739 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 m -101.31 152.4 20.74 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.1 m -133.55 144.95 54.32 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.661 1.585 . . . . 0.0 111.969 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -62.17 150.39 86.93 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.187 2.592 . . . . 0.0 113.879 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.377 0 C-N-CA 125.072 1.349 . . . . 0.0 112.075 174.369 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.9 t . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -85.27 39.56 0.78 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 -173.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -49.49 -47.28 48.68 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.455 1.502 . . . . 0.0 114.776 -171.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -66.05 -37.09 84.96 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.107 1.322 . . . . 0.0 113.608 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -74.55 -37.93 62.87 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.44 1.096 . . . . 0.0 111.729 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.1 t -63.95 -44.88 91.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.528 1.131 . . . . 0.0 111.876 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -56.38 -35.59 67.9 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.207 1.003 . . . . 0.0 113.332 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.6 tp -71.2 -34.08 70.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 110.877 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -72.43 -41.22 66.43 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.792 -1.192 . . . . 0.0 112.192 172.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.6 m -68.45 -29.71 68.42 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.023 -1.048 . . . . 0.0 111.468 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.43 -37.16 74.81 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.203 1.001 . . . . 0.0 111.381 168.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.4 p -67.49 -17.85 64.84 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.7 mt -107.72 1.66 23.19 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.18 2.192 . . . . 0.0 112.783 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.43 28.37 69.79 Favored Glycine 0 CA--C 1.539 1.578 0 O-C-N 120.82 -1.175 . . . . 0.0 115.833 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -142.41 -178.27 5.67 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 119.109 1.454 . . . . 0.0 112.723 178.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 mt -88.79 148.77 23.75 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.64 1.176 . . . . 0.0 112.083 -173.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -92.34 141.11 15.44 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.187 -0.785 . . . . 0.0 111.984 168.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -148.77 129.95 14.56 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.373 1.069 . . . . 0.0 112.982 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.7 m -84.17 118.78 24.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 112.34 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.1 mm -147.69 125.0 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.938 1.695 . . . . 0.0 109.801 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.05 47.37 13.5 Favored Glycine 0 CA--C 1.534 1.25 0 O-C-N 121.646 -0.659 . . . . 0.0 113.872 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 65.74 6.64 4.02 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.27 2.228 . . . . 0.0 116.486 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -146.2 151.66 37.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.238 1.015 . . . . 0.0 113.012 173.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -79.85 142.19 35.47 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 121.831 -0.543 . . . . 0.0 112.464 172.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -140.14 161.19 38.22 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.776 2.03 . . . . 0.0 109.673 169.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -87.78 154.03 20.88 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.766 -0.584 . . . . 0.0 112.548 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.0 m -139.85 146.2 46.03 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 126.542 1.937 . . . . 0.0 111.437 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -65.93 139.6 57.36 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.724 2.282 . . . . 0.0 112.929 -177.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.229 1.012 . . . . 0.0 111.529 171.009 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.4 m . . . . . 0 CA--C 1.546 0.799 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.2 m120 52.35 49.15 21.12 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.706 1.602 . . . . 0.0 110.873 -169.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.73 -36.11 69.35 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -168.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -60.14 -36.58 77.85 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.672 -1.268 . . . . 0.0 113.414 174.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.77 -33.42 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.969 1.308 . . . . 0.0 111.465 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 t -67.44 -47.61 69.67 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.816 0.847 . . . . 0.0 112.21 174.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -60.22 -41.23 92.62 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.824 -1.173 . . . . 0.0 112.049 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -73.69 -30.49 62.91 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.419 1.008 . . . . 0.0 112.661 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 t -60.84 -44.09 97.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -74.63 -33.25 62.52 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.793 -0.567 . . . . 0.0 112.343 176.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -62.35 -30.24 71.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.88 -1.137 . . . . 0.0 111.887 172.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 t -62.85 -33.53 75.44 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 170.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -86.72 -18.93 29.98 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.805 1.242 . . . . 0.0 113.461 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.32 15.62 10.33 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.978 1.751 . . . . 0.0 116.075 173.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -146.96 176.19 10.1 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.526 1.663 . . . . 0.0 114.537 -172.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.53 159.79 33.65 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.328 1.851 . . . . 0.0 111.914 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.61 142.3 13.62 Favored Glycine 0 N--CA 1.474 1.198 0 C-N-CA 124.126 0.87 . . . . 0.0 114.388 -178.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -146.17 160.67 41.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.593 1.557 . . . . 0.0 112.206 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -88.25 137.38 32.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.439 0.696 . . . . 0.0 112.757 171.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.2 mt -71.86 -38.8 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.208 1.803 . . . . 0.0 111.361 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.7 -49.56 0.11 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 126.973 2.225 . . . . 0.0 109.648 -176.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -131.95 -7.88 3.5 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.927 1.291 . . . . 0.0 114.479 169.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -125.59 152.36 45.23 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.062 1.345 . . . . 0.0 113.806 -176.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.1 t -76.43 136.97 39.44 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.565 1.546 . . . . 0.0 114.021 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -133.38 136.41 45.29 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.706 2.402 . . . . 0.0 109.359 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 m -94.86 147.86 22.91 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.24 148.4 51.11 Favored Pre-proline 0 N--CA 1.482 1.137 0 C-N-CA 125.378 1.471 . . . . 0.0 111.996 -176.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -74.04 154.94 47.73 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.879 2.386 . . . . 0.0 113.923 -176.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.333 0 C-N-CA 125.514 1.526 . . . . 0.0 113.037 177.594 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 37.5 t . . . . . 0 CA--C 1.545 0.771 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -74.93 32.66 0.1 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.632 1.573 . . . . 0.0 113.177 174.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.6 tt -56.08 -39.72 72.54 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.982 1.713 . . . . 0.0 112.646 -169.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -63.21 -40.95 98.93 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.233 1.013 . . . . 0.0 112.303 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -74.94 -35.66 62.13 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 118.736 0.698 . . . . 0.0 112.779 173.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.0 m -64.29 -39.93 94.92 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.284 0.493 . . . . 0.0 112.051 175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.83 -34.37 73.0 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.865 -1.147 . . . . 0.0 113.513 176.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 tp -70.74 -44.67 66.33 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.563 1.545 . . . . 0.0 110.12 176.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 t -63.06 -45.07 93.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.738 0.815 . . . . 0.0 112.117 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.5 m -74.28 -27.92 60.96 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.347 -0.846 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 -60.67 -37.51 81.82 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 121.133 -0.979 . . . . 0.0 111.288 167.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.9 m -67.29 -21.74 65.67 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 172.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.8 mt -97.49 -5.26 36.34 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.315 1.446 . . . . 0.0 113.208 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.57 49.02 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.923 1.249 . . . . 0.0 115.924 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.74 168.78 18.89 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 118.938 1.369 . . . . 0.0 113.226 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.9 mt -83.31 143.71 30.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.034 1.334 . . . . 0.0 111.694 -175.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.38 131.9 10.73 Favored Glycine 0 N--CA 1.469 0.834 0 O-C-N 121.537 -0.727 . . . . 0.0 113.278 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -152.98 171.07 18.91 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.792 1.637 . . . . 0.0 111.219 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 64.3 m -122.29 162.03 22.22 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.261 1.424 . . . . 0.0 113.044 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.5 mm -128.16 96.79 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.13 1.772 . . . . 0.0 106.466 168.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.68 -137.93 20.86 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -167.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -76.87 3.19 12.56 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 175.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -121.59 132.23 54.56 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -167.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.4 m -71.18 136.1 47.91 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.587 1.155 . . . . 0.0 113.374 -178.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -150.12 84.08 1.39 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 127.287 2.235 . . . . 0.0 109.886 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -61.62 154.27 25.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.5 m -140.53 156.86 69.19 Favored Pre-proline 0 N--CA 1.488 1.47 0 C-N-CA 126.113 1.765 . . . . 0.0 113.368 -170.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -60.27 147.2 94.56 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 123.803 3.002 . . . . 0.0 116.544 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.228 1.811 . . . . 0.0 113.684 173.77 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 54.26 23.99 4.7 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.885 2.074 . . . . 0.0 115.108 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.7 tp -59.33 -23.89 62.88 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.644 1.178 . . . . 0.0 113.821 -172.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -53.58 -47.24 70.3 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 120.108 1.322 . . . . 0.0 111.624 172.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -71.89 -37.29 70.16 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.017 1.327 . . . . 0.0 113.581 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.71 -46.77 80.9 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 117.946 0.339 . . . . 0.0 111.02 174.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -58.4 -50.58 73.16 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.109 1.364 . . . . 0.0 112.258 175.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.21 -34.85 77.01 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.658 1.572 . . . . 0.0 112.172 -176.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.4 m -63.06 -39.38 94.56 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.08 0.552 . . . . 0.0 111.471 173.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -81.01 -33.71 33.45 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 178.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -68.33 -29.7 68.51 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.326 -1.484 . . . . 0.0 111.905 176.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.6 m -59.38 -27.34 65.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.076 0.95 . . . . 0.0 112.133 169.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -103.31 4.9 36.98 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.508 1.923 . . . . 0.0 113.322 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.04 30.59 46.27 Favored Glycine 0 CA--C 1.538 1.492 0 N-CA-C 116.843 1.497 . . . . 0.0 116.843 174.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -138.87 157.73 45.51 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 120.207 2.004 . . . . 0.0 114.446 177.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 22.9 tp -83.97 144.54 29.08 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.234 1.813 . . . . 0.0 112.305 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.13 145.55 16.29 Favored Glycine 0 CA--C 1.537 1.435 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -137.07 118.04 14.27 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.741 2.017 . . . . 0.0 110.348 169.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 p -71.33 127.23 31.87 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.096 -1.002 . . . . 0.0 110.136 169.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.0 mm -103.4 -33.9 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.206 1.002 . . . . 0.0 111.883 -169.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.2 -110.87 0.42 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.418 1.485 . . . . 0.0 111.154 -170.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -71.95 -27.43 62.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.012 1.325 . . . . 0.0 113.726 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -141.9 135.34 29.37 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.646 1.978 . . . . 0.0 111.458 178.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.8 t -80.01 149.52 30.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.267 1.427 . . . . 0.0 112.318 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.05 162.92 28.75 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.739 1.615 . . . . 0.0 111.257 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -132.52 151.24 51.98 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.778 0.831 . . . . 0.0 112.915 -175.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.9 m -144.78 162.36 38.86 Favored Pre-proline 0 N--CA 1.48 1.067 0 C-N-CA 126.581 1.952 . . . . 0.0 112.531 -169.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.99 142.37 81.16 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 123.106 2.537 . . . . 0.0 114.808 -175.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.401 1.48 . . . . 0.0 114.833 -176.223 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.1 m . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 56.45 30.21 16.66 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 126.515 1.926 . . . . 0.0 113.107 -169.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.03 -29.59 63.5 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -169.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.6 ttp85 -65.15 -45.77 83.63 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.393 1.451 . . . . 0.0 112.003 174.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.78 -40.62 97.88 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.735 0.814 . . . . 0.0 110.525 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.8 t -60.64 -51.72 68.2 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.32 1.448 . . . . 0.0 111.587 175.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.47 -46.78 86.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.37 1.068 . . . . 0.0 113.031 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pp -66.6 -33.53 75.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.941 1.701 . . . . 0.0 111.981 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.5 m -63.85 -46.45 84.95 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.238 0.615 . . . . 0.0 110.981 170.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -77.79 -30.63 51.39 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -61.0 -40.31 93.04 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.111 1.364 . . . . 0.0 110.677 167.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.9 m -67.12 -22.27 65.81 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.797 0.839 . . . . 0.0 113.014 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.72 -14.28 24.93 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.677 1.591 . . . . 0.0 113.782 173.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.79 24.66 24.89 Favored Glycine 0 CA--C 1.542 1.764 0 C-N-CA 125.981 1.753 . . . . 0.0 115.923 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.83 167.87 21.15 Favored 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 119.327 1.564 . . . . 0.0 113.865 -178.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 mt -92.17 136.24 33.35 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.849 1.26 . . . . 0.0 112.76 -170.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.37 149.31 21.84 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.057 0.837 . . . . 0.0 113.839 170.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -153.88 137.84 16.32 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.109 1.763 . . . . 0.0 112.078 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.6 t -83.24 118.18 23.46 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.171 -0.955 . . . . 0.0 110.299 169.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.6 mt -84.17 -35.3 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.824 0.85 . . . . 0.0 110.923 -175.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.8 -68.21 0.13 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.63 1.11 . . . . 0.0 112.67 177.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.69 -24.67 41.58 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.865 -0.786 . . . . 0.0 113.026 175.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -159.96 166.1 30.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.699 1.199 . . . . 0.0 112.398 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.1 t -96.19 133.56 40.36 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.673 1.189 . . . . 0.0 112.437 172.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -133.16 170.71 15.02 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.471 2.308 . . . . 0.0 109.05 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -126.54 154.42 43.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.2 m -146.71 152.39 44.74 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 126.615 1.966 . . . . 0.0 111.757 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.65 146.07 97.08 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 122.784 2.323 . . . . 0.0 113.769 176.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.351 0 C-N-CA 125.545 1.538 . . . . 0.0 111.57 169.768 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -120.29 12.09 11.67 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -169.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.9 t -143.93 114.75 7.74 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.468 1.107 . . . . 0.0 112.956 -176.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -81.58 55.53 2.69 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.515 1.926 . . . . 0.0 110.779 176.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -42.25 -43.57 3.48 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.157 2.183 . . . . 0.0 115.206 -169.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -66.51 -39.47 88.68 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 121.637 2.017 . . . . 0.0 113.869 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -59.09 -38.62 79.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.485 1.514 . . . . 0.0 111.395 170.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 57.9 m -67.24 -48.54 67.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.307 0.643 . . . . 0.0 112.447 172.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.53 -39.22 90.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.129 0.972 . . . . 0.0 112.382 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -74.26 -33.74 63.38 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.936 0.789 . . . . 0.0 112.241 176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -63.23 -39.48 94.73 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.405 -0.809 . . . . 0.0 111.39 171.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -70.54 -41.56 72.36 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.768 -0.582 . . . . 0.0 111.792 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -57.0 -41.47 78.53 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.393 0.997 . . . . 0.0 111.022 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.1 m -62.25 -27.41 68.98 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.331 1.052 . . . . 0.0 113.775 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 tp -86.22 -43.82 12.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.653 1.981 . . . . 0.0 110.422 173.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 150.4 4.67 0.21 Allowed Glycine 0 CA--C 1.534 1.243 0 CA-C-O 117.187 -1.896 . . . . 0.0 117.243 169.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -144.37 177.84 8.35 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.925 2.362 . . . . 0.0 114.516 -168.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.32 159.09 32.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.168 0.987 . . . . 0.0 112.713 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.7 155.5 16.27 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.491 1.044 . . . . 0.0 113.579 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -145.61 150.69 36.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.907 1.683 . . . . 0.0 111.818 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.5 m -77.97 154.15 31.82 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.717 -0.615 . . . . 0.0 111.034 168.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.1 mm -113.33 -37.91 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.982 1.713 . . . . 0.0 110.171 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.77 -111.27 0.39 Allowed Glycine 0 N--CA 1.463 0.47 0 N-CA-C 108.686 -1.765 . . . . 0.0 108.686 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.74 2.73 9.34 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.956 0.902 . . . . 0.0 113.364 168.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -136.52 158.74 43.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.352 2.261 . . . . 0.0 110.425 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.1 p -130.19 152.27 49.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.448 1.499 . . . . 0.0 112.276 173.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -137.91 167.77 21.08 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.53 1.532 . . . . 0.0 112.53 -174.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -109.22 148.76 30.43 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.9 m -144.4 152.64 54.11 Favored Pre-proline 0 N--CA 1.48 1.038 0 C-N-CA 125.636 1.574 . . . . 0.0 113.018 -172.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -61.48 158.7 35.05 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 123.899 3.066 . . . . 0.0 116.153 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.472 0 C-N-CA 127.163 2.185 . . . . 0.0 115.14 176.838 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 122.551 1.167 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -103.18 46.63 0.91 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.031 1.333 . . . . 0.0 113.752 -172.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.8 m 53.96 19.4 1.99 Allowed 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 118.543 2.794 . . . . 0.0 118.543 168.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 57.11 32.64 22.03 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-N 119.759 1.163 . . . . 0.0 111.748 -166.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.62 -37.27 79.62 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 125.926 1.69 . . . . 0.0 112.768 -173.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -43.24 78.75 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.514 1.052 . . . . 0.0 110.013 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 54.5 mtt85 -69.89 -36.74 75.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.57 1.548 . . . . 0.0 112.449 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.2 t -65.43 -53.02 49.0 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.533 0.683 . . . . 0.0 111.128 173.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -23.63 59.32 Favored 'General case' 0 C--O 1.221 -0.43 0 O-C-N 121.031 -1.043 . . . . 0.0 113.365 -172.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.1 tp -59.04 -46.97 86.89 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.965 1.706 . . . . 0.0 110.905 168.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 t -61.3 -34.24 74.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.684 0.793 . . . . 0.0 111.751 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.98 -41.91 58.6 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.79 1.236 . . . . 0.0 112.657 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -63.79 -31.04 72.09 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.198 1.399 . . . . 0.0 112.158 175.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.0 m -62.81 -4.68 2.24 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.775 1.23 . . . . 0.0 113.647 167.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -122.38 -4.1 8.88 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.175 2.19 . . . . 0.0 112.854 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.43 -6.43 71.33 Favored Glycine 0 CA--C 1.542 1.746 0 C-N-CA 126.777 2.132 . . . . 0.0 116.242 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.83 157.1 35.58 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.912 2.085 . . . . 0.0 112.922 170.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.1 mt -110.81 151.82 27.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.507 1.523 . . . . 0.0 109.623 169.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.33 157.06 17.0 Favored Glycine 0 N--CA 1.476 1.327 0 CA-C-N 119.349 0.977 . . . . 0.0 114.508 -178.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -146.74 144.74 29.62 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.855 1.662 . . . . 0.0 112.374 173.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.76 122.95 26.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.103 0.561 . . . . 0.0 110.879 171.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.9 mm -81.16 -22.6 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.586 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.48 -68.16 0.5 Allowed Glycine 0 CA--C 1.524 0.651 0 C-N-CA 126.637 2.065 . . . . 0.0 110.685 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -87.58 -19.42 27.84 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.052 1.741 . . . . 0.0 113.083 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -137.17 162.2 34.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.558 1.943 . . . . 0.0 111.425 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.12 151.24 21.19 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.033 1.333 . . . . 0.0 110.046 168.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -138.63 146.86 42.21 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.333 1.053 . . . . 0.0 110.706 169.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.0 m -115.38 154.97 28.24 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.51 1.124 . . . . 0.0 113.221 173.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.6 m -143.46 155.88 60.59 Favored Pre-proline 0 N--CA 1.471 0.603 0 C-N-CA 126.654 1.982 . . . . 0.0 110.775 -173.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -66.09 156.63 63.73 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.551 2.167 . . . . 0.0 113.289 173.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.218 0 C-N-CA 125.218 1.407 . . . . 0.0 113.199 179.774 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.821 0 CA-C-O 120.514 0.197 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -76.43 -178.98 4.9 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.724 1.21 . . . . 0.0 113.513 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.7 p -123.96 23.46 8.57 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.902 2.081 . . . . 0.0 112.987 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.255 4.5 m-80 57.94 23.65 10.1 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.479 2.312 . . . . 0.0 115.907 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -50.93 -37.02 41.63 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.287 1.035 . . . . 0.0 112.708 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -58.22 -33.22 69.08 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -175.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -97.73 -30.24 12.92 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 119.476 1.035 . . . . 0.0 112.492 172.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -57.01 -48.08 79.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.103 0.961 . . . . 0.0 112.288 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -53.83 -42.11 68.12 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.309 1.044 . . . . 0.0 112.319 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.54 -44.68 70.46 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.248 2.219 . . . . 0.0 111.445 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 t -71.26 -34.7 70.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.783 1.233 . . . . 0.0 112.617 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 57.6 m -71.59 -27.44 63.13 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.487 -0.758 . . . . 0.0 111.608 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -56.64 -31.83 64.73 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.618 1.167 . . . . 0.0 112.212 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.8 t -62.28 -22.58 66.12 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.82 1.248 . . . . 0.0 113.878 174.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.2 mt -105.65 -7.35 18.54 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.934 1.694 . . . . 0.0 113.124 173.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.0 21.35 25.78 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.516 1.531 . . . . 0.0 116.171 173.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.9 167.21 22.52 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.008 1.404 . . . . 0.0 113.278 -177.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.6 mt -79.33 167.59 20.69 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.453 1.501 . . . . 0.0 112.178 -174.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.51 137.29 14.14 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.859 1.218 . . . . 0.0 111.969 169.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -132.72 138.01 47.09 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.353 1.461 . . . . 0.0 110.735 176.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 89.5 m -70.49 124.88 25.28 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 171.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.9 mm -110.51 78.68 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 127.37 2.268 . . . . 0.0 106.805 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.42 -124.38 7.18 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 125.932 1.73 . . . . 0.0 112.415 -172.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -74.57 3.18 8.13 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.498 2.319 . . . . 0.0 114.788 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -151.15 136.25 17.5 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.523 1.129 . . . . 0.0 111.674 -166.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -95.24 138.59 32.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.538 0.735 . . . . 0.0 112.711 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -132.19 156.28 46.72 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 127.494 2.318 . . . . 0.0 110.644 -177.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.4 m -82.67 137.28 34.51 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.591 -0.693 . . . . 0.0 112.399 -175.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 m -136.38 145.27 51.05 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 125.132 1.373 . . . . 0.0 112.776 -173.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -62.66 151.49 83.34 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.248 2.632 . . . . 0.0 113.752 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.134 1.374 . . . . 0.0 113.752 174.908 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -145.23 149.59 35.19 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.387 1.475 . . . . 0.0 110.748 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.7 m -74.2 94.78 2.5 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.013 0.525 . . . . 0.0 112.348 173.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -83.82 55.05 3.1 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.615 1.166 . . . . 0.0 108.879 170.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 19.3 tp -52.45 -33.1 42.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.703 1.601 . . . . 0.0 115.169 -168.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 66.1 ttp85 -62.73 -48.97 76.9 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.768 1.622 . . . . 0.0 112.571 173.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -65.87 -29.6 70.08 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.603 0.761 . . . . 0.0 112.198 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.5 m -68.84 -51.09 44.29 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.672 0.789 . . . . 0.0 110.88 169.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -60.06 -43.3 95.53 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.165 0.986 . . . . 0.0 112.301 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 pp -69.55 -34.66 74.51 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.003 0.82 . . . . 0.0 111.989 -178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t -63.73 -47.35 81.42 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.873 0.869 . . . . 0.0 111.1 171.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -74.79 -37.23 62.43 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 118.118 0.417 . . . . 0.0 112.089 -176.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -61.33 -33.71 74.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.802 1.241 . . . . 0.0 111.738 173.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 m -67.65 -2.45 6.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 171.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.0 mt -124.08 9.96 8.73 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.268 2.227 . . . . 0.0 112.476 172.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.64 -4.86 62.95 Favored Glycine 0 CA--C 1.541 1.689 0 N-CA-C 116.159 1.224 . . . . 0.0 116.159 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.16 171.12 11.57 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.347 2.259 . . . . 0.0 113.174 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 tp -123.53 137.05 54.85 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.338 1.855 . . . . 0.0 108.738 167.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.13 136.31 13.47 Favored Glycine 0 N--CA 1.468 0.82 0 C-N-CA 125.534 1.54 . . . . 0.0 114.583 -176.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -134.42 140.93 46.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.493 1.917 . . . . 0.0 110.881 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.5 t -76.37 140.17 41.29 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.195 -0.941 . . . . 0.0 111.728 169.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.8 mt -85.02 -58.27 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.127 0.971 . . . . 0.0 109.729 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -168.09 -49.37 0.03 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.863 1.697 . . . . 0.0 112.073 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.82 -11.94 6.57 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.623 1.569 . . . . 0.0 113.753 170.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -115.63 149.38 38.4 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.853 1.661 . . . . 0.0 113.181 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.1 m -83.93 147.9 27.23 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.416 1.086 . . . . 0.0 111.951 167.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -131.4 130.09 42.14 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 126.587 1.955 . . . . 0.0 109.245 170.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.6 m -119.71 136.99 54.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.272 0.629 . . . . 0.0 112.359 177.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -137.95 161.99 56.66 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.846 1.658 . . . . 0.0 110.379 -173.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.83 156.75 41.65 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.388 2.059 . . . . 0.0 113.052 172.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.32 175.329 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 120.431 0.158 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.38 157.24 22.6 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.53 1.532 . . . . 0.0 111.998 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m -114.34 154.2 28.46 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.94 1.296 . . . . 0.0 113.527 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -78.49 40.42 0.37 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.338 1.455 . . . . 0.0 111.211 169.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 15.3 tp -57.15 -31.61 65.54 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.117 1.367 . . . . 0.0 114.331 -167.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -58.85 -35.44 72.93 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.466 1.106 . . . . 0.0 113.124 176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -81.79 -35.93 28.98 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.14 1.376 . . . . 0.0 111.642 173.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -61.86 -45.78 92.32 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.164 0.586 . . . . 0.0 112.063 178.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -56.57 -45.91 81.04 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.853 -0.529 . . . . 0.0 111.856 178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -70.08 -39.25 75.71 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.868 2.067 . . . . 0.0 111.591 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.3 m -60.44 -46.19 90.95 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.247 1.019 . . . . 0.0 110.868 173.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.5 m -78.0 -29.66 49.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.527 0.731 . . . . 0.0 112.216 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.66 -38.26 89.63 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 120.375 -1.453 . . . . 0.0 111.255 170.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 49.5 m -70.01 -14.07 62.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.771 1.229 . . . . 0.0 114.103 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -103.26 -14.95 16.13 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.082 1.353 . . . . 0.0 113.159 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.18 37.28 6.32 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.471 1.51 . . . . 0.0 115.286 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -150.94 163.6 38.31 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 118.976 1.388 . . . . 0.0 113.301 175.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.0 mp -90.6 158.43 16.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.269 1.828 . . . . 0.0 111.883 -172.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.87 154.25 16.47 Favored Glycine 0 N--CA 1.478 1.49 0 N-CA-C 115.6 1.0 . . . . 0.0 115.6 -176.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -151.16 140.22 21.11 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.129 1.772 . . . . 0.0 113.244 173.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.8 t -75.51 138.84 41.82 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 120.787 -1.196 . . . . 0.0 111.992 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.3 mt -142.25 103.33 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-O 122.33 1.062 . . . . 0.0 112.074 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.47 -60.16 2.84 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 127.942 2.687 . . . . 0.0 114.582 168.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.26 5.6 0.64 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -159.7 154.62 24.68 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 119.073 0.851 . . . . 0.0 110.968 -178.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.98 146.64 27.89 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.292 -0.88 . . . . 0.0 112.695 177.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -128.63 158.41 38.59 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.7 1.6 . . . . 0.0 109.86 171.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 88.2 m -119.16 153.71 34.45 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.734 0.778 . . . . 0.0 112.63 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 m -140.73 151.48 63.23 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 126.287 1.835 . . . . 0.0 111.837 -168.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -65.44 155.98 65.89 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.902 2.401 . . . . 0.0 116.648 -168.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.385 0 C-N-CA 126.824 2.05 . . . . 0.0 114.298 174.919 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -97.93 158.45 15.53 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.334 1.054 . . . . 0.0 113.46 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.9 t -115.07 150.07 36.51 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.773 1.629 . . . . 0.0 111.31 171.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -71.58 34.75 0.06 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.302 1.841 . . . . 0.0 112.524 169.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tt -49.16 -46.7 45.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.686 1.994 . . . . 0.0 113.737 -167.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -67.9 -37.38 81.65 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -64.25 -42.57 96.45 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.312 1.445 . . . . 0.0 110.988 169.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.0 m -66.03 -43.14 88.49 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.221 0.608 . . . . 0.0 111.888 179.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -62.78 -35.41 79.75 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.884 -1.135 . . . . 0.0 112.58 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 tp -69.67 -37.54 76.73 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.791 1.636 . . . . 0.0 111.027 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.4 t -65.25 -44.51 87.9 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.074 -1.016 . . . . 0.0 111.33 173.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 55.9 m -70.65 -26.59 63.53 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.143 -0.973 . . . . 0.0 112.222 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -60.63 -24.71 65.75 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.043 -1.036 . . . . 0.0 112.396 170.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.3 p -63.38 -38.9 92.92 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.466 1.03 . . . . 0.0 112.848 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.4 mt -98.39 12.5 34.74 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.377 1.471 . . . . 0.0 113.045 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.49 22.11 56.99 Favored Glycine 0 CA--C 1.535 1.291 0 N-CA-C 116.725 1.45 . . . . 0.0 116.725 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.11 -174.56 3.58 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.211 1.506 . . . . 0.0 113.844 -175.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.7 tp -97.76 156.45 16.56 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.673 1.589 . . . . 0.0 111.905 -174.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.04 150.67 17.14 Favored Glycine 0 N--CA 1.474 1.229 0 C-N-CA 124.723 1.154 . . . . 0.0 114.329 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -137.93 149.47 46.21 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.016 2.126 . . . . 0.0 112.159 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.2 m -91.05 145.5 24.64 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.789 1.236 . . . . 0.0 112.632 174.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.7 mm -139.83 74.78 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.573 1.549 . . . . 0.0 108.715 169.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.02 -120.06 8.39 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.225 1.393 . . . . 0.0 112.974 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -75.09 -5.53 44.71 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.474 -1.015 . . . . 0.0 113.425 172.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -120.13 177.9 4.83 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.894 1.678 . . . . 0.0 111.717 -178.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 30.1 m -136.09 162.47 32.81 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 125.073 1.349 . . . . 0.0 112.591 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -136.01 175.73 9.33 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.357 2.263 . . . . 0.0 110.767 171.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.4 m -116.14 164.38 14.56 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.581 0.752 . . . . 0.0 110.59 168.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -142.12 149.21 51.37 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.947 1.699 . . . . 0.0 110.348 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.1 139.58 85.54 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.688 2.259 . . . . 0.0 112.018 177.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.293 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -176.643 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.711 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -80.69 163.43 23.58 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.02 1.328 . . . . 0.0 113.105 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.2 t -68.1 129.61 40.44 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.655 1.182 . . . . 0.0 113.656 -172.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -81.02 54.3 2.18 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.574 1.549 . . . . 0.0 110.985 168.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.4 tt -47.83 -39.22 17.79 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.939 2.096 . . . . 0.0 112.891 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -59.81 -40.27 87.82 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.705 1.202 . . . . 0.0 113.573 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -71.0 -36.39 72.45 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.078 1.751 . . . . 0.0 111.657 172.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.4 m -66.33 -43.28 86.6 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.191 0.905 . . . . 0.0 112.8 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 49.4 mt-10 -62.26 -38.47 89.4 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.035 -1.04 . . . . 0.0 112.547 176.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.5 -42.51 87.27 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.02 1.728 . . . . 0.0 110.347 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.6 t -59.84 -47.91 83.84 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.361 1.065 . . . . 0.0 111.592 174.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.0 m -74.04 -21.16 60.06 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.958 -1.089 . . . . 0.0 112.931 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -61.76 -22.05 65.07 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.921 -1.112 . . . . 0.0 112.549 169.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 p -74.55 -28.4 60.93 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 170.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.2 mt -90.84 -15.72 29.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.675 1.99 . . . . 0.0 113.319 177.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.13 18.11 11.77 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.527 1.537 . . . . 0.0 116.053 174.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -155.12 -178.12 7.02 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 119.743 1.772 . . . . 0.0 113.26 -173.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.58 167.19 21.63 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.219 1.408 . . . . 0.0 111.264 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.405 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -142.98 146.04 16.5 Favored Glycine 0 N--CA 1.473 1.145 0 O-C-N 121.029 -1.044 . . . . 0.0 114.915 -174.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -147.24 152.6 38.59 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.962 2.105 . . . . 0.0 110.393 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.8 m -77.74 131.8 37.83 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.123 -0.986 . . . . 0.0 112.301 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.8 mm -130.18 87.1 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-O 122.866 1.317 . . . . 0.0 108.674 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.13 -143.79 31.26 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 113.85 -1.523 . . . . 0.0 112.383 -170.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -74.83 21.74 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -155.83 149.36 24.92 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.665 -1.272 . . . . 0.0 112.304 -175.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.7 m -79.95 135.26 36.36 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 113.297 175.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -117.77 158.96 23.83 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.655 1.982 . . . . 0.0 110.032 167.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.4 m -113.87 149.03 35.68 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -169.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.8 m -135.11 153.06 78.1 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 125.794 1.637 . . . . 0.0 112.041 -170.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -67.77 151.11 79.08 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.813 2.342 . . . . 0.0 115.683 -169.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.607 1.563 . . . . 0.0 113.882 171.501 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.495 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -96.02 153.1 17.95 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.916 1.286 . . . . 0.0 112.791 -174.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.3 t -82.52 148.42 28.11 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.473 0.709 . . . . 0.0 112.862 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -81.28 49.76 1.33 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.549 1.939 . . . . 0.0 112.036 178.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.4 tp -61.81 -40.77 96.41 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -172.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -66.48 -33.43 75.67 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 120.1 1.318 . . . . 0.0 112.061 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -73.64 -38.64 64.95 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.908 0.883 . . . . 0.0 112.224 168.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -59.17 -42.22 90.29 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.024 0.829 . . . . 0.0 111.563 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.38 -47.52 78.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.168 0.987 . . . . 0.0 112.632 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.3 tp -73.06 -29.99 63.37 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.862 1.665 . . . . 0.0 112.119 -177.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.0 t -63.94 -36.87 85.37 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.433 1.093 . . . . 0.0 111.649 169.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.47 -30.93 33.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.273 -0.892 . . . . 0.0 113.008 176.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -52.26 -36.63 53.15 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.003 0.921 . . . . 0.0 111.57 169.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 p -57.44 -28.63 63.5 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 176.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.4 mt -104.38 5.47 34.4 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.56 1.944 . . . . 0.0 113.698 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.14 12.42 67.98 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -134.57 178.24 7.15 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.594 1.697 . . . . 0.0 112.608 -177.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.0 mt -83.03 160.33 21.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.588 1.155 . . . . 0.0 111.906 -176.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.9 153.0 17.57 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 123.83 0.729 . . . . 0.0 112.672 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -149.88 132.07 15.44 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.87 0.868 . . . . 0.0 111.679 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.5 t -86.18 124.77 32.95 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.79 0.436 . . . . 0.0 110.611 169.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.19 33.82 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.811 1.644 . . . . 0.0 110.553 -175.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.34 -64.5 1.36 Allowed Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.769 1.652 . . . . 0.0 113.317 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -74.83 -33.87 62.23 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.276 1.43 . . . . 0.0 113.504 -176.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -158.79 155.3 27.66 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.466 1.106 . . . . 0.0 112.593 -168.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -83.69 143.93 29.72 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.604 1.162 . . . . 0.0 111.355 169.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -151.09 161.08 43.4 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.185 1.394 . . . . 0.0 111.959 167.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.3 m -94.7 150.42 20.24 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -141.97 148.48 48.98 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 125.774 1.63 . . . . 0.0 111.136 -173.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -65.61 138.07 52.79 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.203 2.602 . . . . 0.0 113.965 -172.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.073 1.749 . . . . 0.0 113.746 179.561 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -65.6 146.91 54.24 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.445 0.641 . . . . 0.0 112.315 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 27.7 p -67.36 144.49 55.78 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 122.278 1.037 . . . . 0.0 113.485 178.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -79.1 49.85 0.99 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 128.312 2.645 . . . . 0.0 111.612 177.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -47.48 -37.82 12.58 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.972 1.309 . . . . 0.0 113.445 -170.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -57.46 -45.06 85.19 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.175 0.99 . . . . 0.0 113.63 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.4 tpm_? -73.13 -37.26 66.72 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.173 1.789 . . . . 0.0 110.889 173.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 64.2 m -60.48 -43.37 97.05 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.413 0.685 . . . . 0.0 112.826 175.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -56.27 -47.04 79.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.534 1.061 . . . . 0.0 110.947 172.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 tp -63.21 -39.53 94.88 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.566 1.546 . . . . 0.0 111.503 177.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 m -63.06 -37.82 88.73 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.503 1.521 . . . . 0.0 113.186 171.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 64.5 m -78.08 -34.92 49.98 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.627 -0.671 . . . . 0.0 111.904 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -30.53 71.36 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.857 -1.152 . . . . 0.0 111.762 176.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.7 t -63.24 -41.64 99.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 0.0 111.676 168.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.15 -6.41 54.69 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.151 1.38 . . . . 0.0 113.662 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.54 13.15 56.09 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 125.981 1.753 . . . . 0.0 115.79 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -141.63 171.86 13.48 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.898 1.349 . . . . 0.0 113.404 -175.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.4 mt -75.07 151.09 38.69 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.078 1.351 . . . . 0.0 112.289 -173.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.34 136.88 12.94 Favored Glycine 0 N--CA 1.471 0.98 0 O-C-N 121.409 -0.807 . . . . 0.0 112.864 173.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -143.55 166.93 23.46 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.848 1.659 . . . . 0.0 110.874 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 t -150.07 153.43 36.42 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -173.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -129.48 103.07 8.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 126.349 1.859 . . . . 0.0 107.53 167.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.03 -102.3 0.34 Allowed Glycine 0 CA--C 1.534 1.278 0 C-N-CA 127.087 2.28 . . . . 0.0 114.533 176.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.03 10.48 28.88 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.816 2.047 . . . . 0.0 113.034 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -143.15 115.6 8.55 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.138 -1.601 . . . . 0.0 113.677 -173.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.2 m -84.6 138.91 32.45 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.66 1.584 . . . . 0.0 112.311 169.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -144.17 135.88 26.0 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 125.354 1.462 . . . . 0.0 110.495 169.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 m -78.32 153.43 31.73 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.9 m -141.82 148.95 51.43 Favored Pre-proline 0 N--CA 1.478 0.942 0 C-N-CA 124.856 1.263 . . . . 0.0 112.054 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_exo -67.67 161.74 42.38 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.658 2.239 . . . . 0.0 112.961 170.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.258 1.533 0 C-N-CA 124.748 1.219 . . . . 0.0 112.765 174.179 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.138 0.494 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 57.15 30.45 18.34 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 115.629 1.715 . . . . 0.0 115.629 169.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.8 p -82.95 -1.14 51.62 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -178.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.9 m120 51.73 32.92 10.12 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 127.511 2.324 . . . . 0.0 114.897 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.7 -31.0 24.3 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.715 1.746 . . . . 0.0 115.715 -168.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 55.5 ttp180 -59.02 -40.19 84.24 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.12 1.327 . . . . 0.0 112.245 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 mmm180 -70.34 -39.78 74.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.469 1.107 . . . . 0.0 111.569 174.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.3 m -67.62 -43.7 79.77 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.269 -177.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -64.42 -34.72 78.85 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.196 -0.94 . . . . 0.0 113.194 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tp -66.93 -36.69 82.8 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 110.393 171.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.9 m -66.88 -42.44 85.56 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.463 -0.773 . . . . 0.0 111.397 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.96 -36.86 75.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.879 0.763 . . . . 0.0 111.669 175.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -54.65 -40.71 69.28 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.995 -1.065 . . . . 0.0 111.163 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.1 m -75.01 3.27 8.66 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.885 1.674 . . . . 0.0 114.693 176.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -123.9 2.47 8.74 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.008 2.123 . . . . 0.0 112.271 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.35 19.53 66.41 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 125.387 1.47 . . . . 0.0 115.884 177.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -139.9 173.32 11.64 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.81 1.805 . . . . 0.0 112.747 -177.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.6 mt -86.58 176.74 7.65 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.164 1.386 . . . . 0.0 111.553 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -154.46 153.92 25.15 Favored Glycine 0 N--CA 1.474 1.171 0 O-C-N 120.902 -1.124 . . . . 0.0 115.128 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -141.32 147.43 38.11 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.446 1.498 . . . . 0.0 112.226 -174.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.1 t -81.64 133.85 35.41 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.747 0.819 . . . . 0.0 112.178 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.0 mt -122.32 65.08 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 127.075 2.15 . . . . 0.0 108.877 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.95 -69.73 0.78 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 127.209 2.337 . . . . 0.0 115.016 176.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -100.74 -18.03 16.67 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.031 1.332 . . . . 0.0 112.954 -174.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -146.52 176.32 9.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 126.371 1.868 . . . . 0.0 112.143 -169.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 29.6 p -126.82 142.68 51.48 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.896 1.278 . . . . 0.0 111.396 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -135.6 150.73 49.76 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.151 0.98 . . . . 0.0 111.853 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 m -79.55 155.03 28.38 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 169.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -143.51 151.0 53.1 Favored Pre-proline 0 N--CA 1.476 0.852 0 C-N-CA 126.206 1.803 . . . . 0.0 111.039 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -59.2 146.7 93.68 Favored 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.192 2.595 . . . . 0.0 114.954 -173.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.966 1.706 . . . . 0.0 112.487 173.41 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -83.46 -11.91 56.96 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 170.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m -69.38 100.71 1.41 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.979 1.312 . . . . 0.0 108.06 166.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.42 45.53 0.67 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.54 1.536 . . . . 0.0 111.14 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.48 -38.49 44.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.463 2.305 . . . . 0.0 113.063 -168.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -64.31 -35.35 80.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.313 -0.867 . . . . 0.0 112.773 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -85.56 -32.15 22.29 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.359 1.464 . . . . 0.0 113.545 171.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -68.46 -35.46 77.59 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.089 0.859 . . . . 0.0 112.354 176.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.23 -36.47 66.05 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.194 -1.566 . . . . 0.0 111.954 169.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.4 tp -82.05 -37.78 25.94 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.06 1.744 . . . . 0.0 111.37 -177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 83.6 p -65.0 -41.81 95.06 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.474 1.033 . . . . 0.0 111.179 175.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.25 -41.92 84.81 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.008 -0.432 . . . . 0.0 110.425 174.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -61.86 -33.35 74.03 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.811 -1.181 . . . . 0.0 112.402 176.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 41.7 t -66.4 -29.35 69.48 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.064 0.946 . . . . 0.0 112.658 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.79 -48.04 17.51 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.92 -1.112 . . . . 0.0 111.126 170.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 144.65 15.71 0.22 Allowed Glycine 0 CA--C 1.537 1.453 0 CA-C-O 117.82 -1.544 . . . . 0.0 116.098 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -145.94 179.53 7.41 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 120.202 2.001 . . . . 0.0 113.132 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.3 mt -88.46 160.05 17.7 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.851 -1.155 . . . . 0.0 112.844 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.26 138.7 15.14 Favored Glycine 0 N--CA 1.469 0.881 0 C-N-CA 124.295 0.95 . . . . 0.0 113.801 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -141.7 171.25 14.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.354 2.261 . . . . 0.0 109.826 172.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.0 t -150.06 139.01 20.99 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 -174.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.8 mm -117.91 115.41 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.468 1.907 . . . . 0.0 110.57 -174.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -87.03 0.18 Allowed Glycine 0 N--CA 1.468 0.805 0 C-N-CA 126.139 1.828 . . . . 0.0 111.676 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 50.0 mp0 -129.42 5.23 5.18 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.17 1.788 . . . . 0.0 112.71 172.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -115.77 117.17 29.49 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.169 0.988 . . . . 0.0 113.163 -168.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.0 m -74.36 138.98 43.78 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 120.569 -1.332 . . . . 0.0 113.153 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -147.13 127.22 13.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.793 1.637 . . . . 0.0 111.285 176.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.8 m -77.65 147.69 35.42 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -130.18 148.29 69.15 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 126.532 1.933 . . . . 0.0 110.64 -175.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -65.26 145.29 83.51 Favored 'Trans proline' 0 C--O 1.239 0.547 0 C-N-CA 122.44 2.094 . . . . 0.0 112.901 -171.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 C-N-CA 125.493 1.517 . . . . 0.0 111.158 177.138 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 120.689 0.281 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -88.63 154.13 20.57 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.238 1.015 . . . . 0.0 113.281 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.5 t -154.1 162.85 40.91 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 126.152 1.781 . . . . 0.0 111.278 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -111.65 66.5 0.63 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.196 1.798 . . . . 0.0 111.401 -168.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.56 -42.08 15.32 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.207 1.803 . . . . 0.0 114.073 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -65.43 -34.04 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 120.24 -1.538 . . . . 0.0 113.519 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -73.1 -38.14 66.48 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.955 0.902 . . . . 0.0 111.29 172.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.7 t -62.65 -40.84 98.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.473 1.109 . . . . 0.0 112.098 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -58.25 -41.54 84.46 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.864 1.265 . . . . 0.0 112.446 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.2 tp -69.71 -42.71 73.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.377 0.989 . . . . 0.0 110.125 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.9 t -57.82 -39.02 76.62 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.788 -0.57 . . . . 0.0 112.485 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.4 m -79.67 -32.92 41.55 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.474 -0.766 . . . . 0.0 112.975 175.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -60.49 -29.65 69.21 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.644 -1.285 . . . . 0.0 112.539 170.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.6 p -67.64 -14.47 62.97 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 172.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -103.24 -24.71 13.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.151 1.78 . . . . 0.0 112.502 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.01 2.14 28.38 Favored Glycine 0 CA--C 1.542 1.759 0 C-N-CA 125.905 1.717 . . . . 0.0 116.076 174.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.449 ' H ' HD23 ' A' ' 17' ' ' LEU . 1.8 pt? -121.24 171.96 8.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.983 1.713 . . . . 0.0 112.347 -178.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.2 tp -73.74 154.31 39.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.952 1.301 . . . . 0.0 112.117 -173.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.95 141.89 15.61 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 123.933 0.778 . . . . 0.0 113.938 175.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -138.2 153.39 49.16 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.602 1.561 . . . . 0.0 111.729 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.9 m -100.19 95.28 6.71 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.247 1.419 . . . . 0.0 110.183 172.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -82.86 68.65 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-O 123.204 1.478 . . . . 0.0 110.146 -176.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.84 -92.33 0.19 Allowed Glycine 0 CA--C 1.525 0.713 0 C-N-CA 127.083 2.278 . . . . 0.0 111.879 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -66.78 -28.61 68.53 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 -177.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -155.96 168.06 28.44 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.75 1.613 . . . . 0.0 114.739 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 t -70.92 132.8 45.77 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.932 0.893 . . . . 0.0 112.712 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -140.07 139.24 35.86 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.15 1.38 . . . . 0.0 110.12 168.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.6 m -87.19 152.69 22.1 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.825 -0.547 . . . . 0.0 112.24 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -138.79 151.8 69.25 Favored Pre-proline 0 N--CA 1.48 1.03 0 C-N-CA 125.088 1.355 . . . . 0.0 111.848 -174.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -65.23 130.5 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 122.713 2.275 . . . . 0.0 111.293 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.404 0 C-N-CA 124.807 1.243 . . . . 0.0 113.417 -174.635 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 119.696 -0.192 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -117.2 5.02 12.65 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.053 1.341 . . . . 0.0 114.303 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.3 p -66.02 164.19 15.77 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.061 1.745 . . . . 0.0 112.789 176.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -84.93 44.2 1.05 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.543 1.937 . . . . 0.0 112.754 -176.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.97 -39.61 90.52 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.36 1.464 . . . . 0.0 113.062 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.44 -44.51 68.91 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.244 1.418 . . . . 0.0 110.865 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -69.28 -38.06 78.18 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.978 1.711 . . . . 0.0 112.97 172.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.0 t -61.75 -41.43 97.66 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.502 0.592 . . . . 0.0 112.478 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -63.06 -34.74 78.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.22 -0.925 . . . . 0.0 112.288 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -45.29 65.49 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.738 2.415 . . . . 0.0 110.839 174.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.0 t -58.4 -48.95 79.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.568 1.147 . . . . 0.0 111.509 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 56.7 m -70.88 -31.94 68.75 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.381 -0.824 . . . . 0.0 111.871 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -60.89 -24.79 66.24 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.618 -1.301 . . . . 0.0 113.244 169.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 p -61.84 -28.91 69.82 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.279 1.399 . . . . 0.0 112.326 173.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.06 -2.5 27.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.222 2.209 . . . . 0.0 113.404 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.63 30.83 20.32 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 174.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.5 171.87 13.46 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 119.812 1.806 . . . . 0.0 113.73 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.3 mt -79.25 170.96 15.85 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.977 1.711 . . . . 0.0 112.291 -175.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.99 146.58 17.94 Favored Glycine 0 CA--C 1.537 1.411 0 N-CA-C 115.401 0.92 . . . . 0.0 115.401 -175.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -140.6 156.33 46.31 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.593 2.357 . . . . 0.0 111.508 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.1 p -110.05 55.4 0.64 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.108 1.363 . . . . 0.0 112.512 174.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.9 mm -55.49 -47.6 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.297 1.439 . . . . 0.0 113.446 -168.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -107.9 41.66 2.15 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.652 1.596 . . . . 0.0 112.257 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 64.21 -33.4 0.14 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 127.37 2.268 . . . . 0.0 114.837 -169.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -79.59 150.78 30.94 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.951 1.701 . . . . 0.0 112.096 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -65.16 131.68 47.17 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -176.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -129.14 128.5 43.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.255 2.222 . . . . 0.0 109.099 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 27.9 m -85.1 147.52 26.6 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 174.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.3 m -137.07 149.3 65.88 Favored Pre-proline 0 N--CA 1.479 1.011 0 C-N-CA 124.912 1.285 . . . . 0.0 112.107 -170.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.04 137.72 38.29 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 123.297 2.665 . . . . 0.0 114.404 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 C-N-CA 126.574 1.95 . . . . 0.0 113.114 -178.971 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 110.55 -0.167 . . . . 0.0 110.55 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -88.22 64.1 7.5 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.559 1.944 . . . . 0.0 110.058 -176.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.3 m -53.47 143.02 20.5 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 -166.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.41 36.62 0.43 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.507 1.923 . . . . 0.0 112.492 174.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.1 mt -55.87 -48.01 76.34 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.021 1.328 . . . . 0.0 113.453 -170.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.7 ttp85 -63.8 -34.81 78.74 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.656 -1.278 . . . . 0.0 111.341 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -72.08 -34.31 68.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 126.883 2.073 . . . . 0.0 113.906 176.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.91 -40.38 28.35 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.782 0.719 . . . . 0.0 112.127 175.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -53.39 -35.07 59.96 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.63 1.572 . . . . 0.0 112.974 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.32 -31.6 72.49 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.591 1.087 . . . . 0.0 112.994 177.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.0 t -77.6 -39.33 45.9 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.409 1.084 . . . . 0.0 111.07 171.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.9 m -66.3 -38.64 88.22 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.084 -1.01 . . . . 0.0 111.372 176.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -43.48 89.82 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.52 1.128 . . . . 0.0 111.196 170.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -59.3 -32.89 70.46 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.484 0.714 . . . . 0.0 112.872 175.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 97.0 mt -91.17 -4.8 55.8 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.006 1.722 . . . . 0.0 113.632 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 29.88 57.74 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.711 1.624 . . . . 0.0 115.907 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -141.31 178.43 7.42 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 118.42 1.11 . . . . 0.0 112.489 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -91.58 147.62 22.87 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.975 -1.078 . . . . 0.0 112.415 -169.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -88.77 137.39 14.22 Favored Glycine 0 CA--C 1.533 1.167 0 O-C-N 121.462 -0.773 . . . . 0.0 112.368 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -145.26 137.02 25.47 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.701 1.2 . . . . 0.0 111.023 176.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -81.67 73.68 8.7 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.415 -0.803 . . . . 0.0 110.901 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 pt -64.12 -17.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -170.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.17 115.84 0.34 Allowed Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.458 1.028 . . . . 0.0 111.908 169.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 61.99 -35.74 0.11 Allowed 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 128.951 2.9 . . . . 0.0 115.889 -172.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -139.17 158.01 44.93 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 127.556 2.342 . . . . 0.0 110.644 -175.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -87.21 140.79 29.19 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.033 1.123 . . . . 0.0 114.033 -178.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -134.44 156.67 48.15 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.996 1.719 . . . . 0.0 108.982 168.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 5.6 m -85.05 144.71 28.08 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.054 -0.404 . . . . 0.0 111.436 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.7 m -135.93 148.19 64.02 Favored Pre-proline 0 N--CA 1.471 0.581 0 C-N-CA 125.81 1.644 . . . . 0.0 111.016 -173.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.16 151.67 72.48 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.661 2.241 . . . . 0.0 111.382 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.337 0 C-N-CA 125.19 1.396 . . . . 0.0 112.073 174.989 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.9 0.381 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -57.82 157.92 6.97 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.651 1.18 . . . . 0.0 113.007 177.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.3 t -68.35 -3.02 9.64 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -169.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 m120 56.65 47.51 18.24 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.415 2.286 . . . . 0.0 111.654 -169.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 10.0 tt -53.86 -34.64 59.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.461 1.504 . . . . 0.0 113.193 -174.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.8 ttp180 -69.06 -32.85 72.61 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.762 0.825 . . . . 0.0 112.287 179.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -69.64 -43.69 72.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.655 1.182 . . . . 0.0 110.432 170.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.2 t -58.34 -49.26 77.85 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.098 0.959 . . . . 0.0 111.864 176.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -58.11 -41.92 84.62 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.889 0.876 . . . . 0.0 113.191 174.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.72 -39.88 95.39 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.953 1.301 . . . . 0.0 110.802 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 p -59.88 -36.73 77.55 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.605 -0.684 . . . . 0.0 112.253 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.4 m -85.6 -37.01 20.01 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.99 0.916 . . . . 0.0 112.667 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -56.8 -39.61 74.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.883 1.673 . . . . 0.0 112.067 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 m -62.36 -23.15 66.64 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.186 0.994 . . . . 0.0 113.108 175.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.7 mt -103.79 7.05 37.08 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 127.649 2.38 . . . . 0.0 113.714 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.5 23.07 61.14 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 125.099 1.333 . . . . 0.0 116.287 174.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.84 176.76 9.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.749 1.775 . . . . 0.0 113.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.8 mt -91.23 151.98 20.7 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.802 0.841 . . . . 0.0 112.537 -169.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.96 142.82 16.19 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.285 0.945 . . . . 0.0 114.314 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -134.57 114.36 12.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.324 1.45 . . . . 0.0 109.321 177.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -105.88 117.43 34.02 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.229 1.012 . . . . 0.0 110.719 -171.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.6 mt -83.06 -45.7 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 C-N-CA 124.354 1.061 . . . . 0.0 111.142 -170.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 137.57 107.0 0.79 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 126.442 1.973 . . . . 0.0 109.078 -169.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 60.68 4.99 0.83 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.055 1.742 . . . . 0.0 115.606 -167.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -149.8 147.32 27.86 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.446 1.498 . . . . 0.0 112.351 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.5 t -127.27 143.76 51.18 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.387 1.875 . . . . 0.0 110.833 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -136.07 159.11 42.73 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.674 1.99 . . . . 0.0 109.739 169.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.9 m -101.31 152.4 20.74 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.1 m -133.55 144.95 54.32 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 125.661 1.585 . . . . 0.0 111.969 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -62.17 150.39 86.93 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.187 2.592 . . . . 0.0 113.879 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.377 0 C-N-CA 125.072 1.349 . . . . 0.0 112.075 174.369 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -146.79 34.54 0.93 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.569 1.148 . . . . 0.0 114.015 -168.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.9 t -71.15 146.58 49.06 Favored 'General case' 0 CA--C 1.55 0.947 0 O-C-N 120.972 -1.08 . . . . 0.0 113.778 -172.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -85.27 39.56 0.78 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 -173.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -49.49 -47.28 48.68 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.455 1.502 . . . . 0.0 114.776 -171.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -66.05 -37.09 84.96 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.107 1.322 . . . . 0.0 113.608 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -74.55 -37.93 62.87 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.44 1.096 . . . . 0.0 111.729 174.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 39.1 t -63.95 -44.88 91.48 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.528 1.131 . . . . 0.0 111.876 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -56.38 -35.59 67.9 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.207 1.003 . . . . 0.0 113.332 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.6 tp -71.2 -34.08 70.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 110.877 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -72.43 -41.22 66.43 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.792 -1.192 . . . . 0.0 112.192 172.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 22.6 m -68.45 -29.71 68.42 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.023 -1.048 . . . . 0.0 111.468 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -58.43 -37.16 74.81 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.203 1.001 . . . . 0.0 111.381 168.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.4 p -67.49 -17.85 64.84 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.7 mt -107.72 1.66 23.19 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.18 2.192 . . . . 0.0 112.783 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.43 28.37 69.79 Favored Glycine 0 CA--C 1.539 1.578 0 O-C-N 120.82 -1.175 . . . . 0.0 115.833 176.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -142.41 -178.27 5.67 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 119.109 1.454 . . . . 0.0 112.723 178.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 mt -88.79 148.77 23.75 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.64 1.176 . . . . 0.0 112.083 -173.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -92.34 141.11 15.44 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.187 -0.785 . . . . 0.0 111.984 168.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -148.77 129.95 14.56 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.373 1.069 . . . . 0.0 112.982 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.7 m -84.17 118.78 24.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.197 1.399 . . . . 0.0 112.34 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.1 mm -147.69 125.0 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.938 1.695 . . . . 0.0 109.801 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.05 47.37 13.5 Favored Glycine 0 CA--C 1.534 1.25 0 O-C-N 121.646 -0.659 . . . . 0.0 113.872 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 65.74 6.64 4.02 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.27 2.228 . . . . 0.0 116.486 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -146.2 151.66 37.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.238 1.015 . . . . 0.0 113.012 173.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -79.85 142.19 35.47 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 121.831 -0.543 . . . . 0.0 112.464 172.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -140.14 161.19 38.22 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.776 2.03 . . . . 0.0 109.673 169.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.5 m -87.78 154.03 20.88 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.766 -0.584 . . . . 0.0 112.548 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.0 m -139.85 146.2 46.03 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 126.542 1.937 . . . . 0.0 111.437 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -65.93 139.6 57.36 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.724 2.282 . . . . 0.0 112.929 -177.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.229 1.012 . . . . 0.0 111.529 171.009 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 119.657 -0.211 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 52.77 27.06 4.97 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -179.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.4 m -76.18 21.61 0.17 Allowed 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 115.691 1.737 . . . . 0.0 115.691 -169.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.2 m120 52.35 49.15 21.12 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.706 1.602 . . . . 0.0 110.873 -169.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.73 -36.11 69.35 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -168.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -60.14 -36.58 77.85 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.672 -1.268 . . . . 0.0 113.414 174.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.77 -33.42 66.3 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.969 1.308 . . . . 0.0 111.465 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.3 t -67.44 -47.61 69.67 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.816 0.847 . . . . 0.0 112.21 174.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -60.22 -41.23 92.62 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.824 -1.173 . . . . 0.0 112.049 178.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pp -73.69 -30.49 62.91 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.419 1.008 . . . . 0.0 112.661 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.3 t -60.84 -44.09 97.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -74.63 -33.25 62.52 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.793 -0.567 . . . . 0.0 112.343 176.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -62.35 -30.24 71.03 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.88 -1.137 . . . . 0.0 111.887 172.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 t -62.85 -33.53 75.44 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 170.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -86.72 -18.93 29.98 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.805 1.242 . . . . 0.0 113.461 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.32 15.62 10.33 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.978 1.751 . . . . 0.0 116.075 173.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -146.96 176.19 10.1 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.526 1.663 . . . . 0.0 114.537 -172.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.53 159.79 33.65 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.328 1.851 . . . . 0.0 111.914 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.61 142.3 13.62 Favored Glycine 0 N--CA 1.474 1.198 0 C-N-CA 124.126 0.87 . . . . 0.0 114.388 -178.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -146.17 160.67 41.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.593 1.557 . . . . 0.0 112.206 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -88.25 137.38 32.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.439 0.696 . . . . 0.0 112.757 171.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.2 mt -71.86 -38.8 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.208 1.803 . . . . 0.0 111.361 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.7 -49.56 0.11 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 126.973 2.225 . . . . 0.0 109.648 -176.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -131.95 -7.88 3.5 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.927 1.291 . . . . 0.0 114.479 169.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -125.59 152.36 45.23 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.062 1.345 . . . . 0.0 113.806 -176.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.1 t -76.43 136.97 39.44 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.565 1.546 . . . . 0.0 114.021 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -133.38 136.41 45.29 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.706 2.402 . . . . 0.0 109.359 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 m -94.86 147.86 22.91 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.24 148.4 51.11 Favored Pre-proline 0 N--CA 1.482 1.137 0 C-N-CA 125.378 1.471 . . . . 0.0 111.996 -176.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -74.04 154.94 47.73 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.879 2.386 . . . . 0.0 113.923 -176.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.333 0 C-N-CA 125.514 1.526 . . . . 0.0 113.037 177.594 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 119.555 -0.26 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -66.15 145.36 55.89 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 172.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 37.5 t -137.59 152.62 49.59 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.032 1.333 . . . . 0.0 112.129 -179.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -74.93 32.66 0.1 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.632 1.573 . . . . 0.0 113.177 174.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.6 tt -56.08 -39.72 72.54 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.982 1.713 . . . . 0.0 112.646 -169.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -63.21 -40.95 98.93 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.233 1.013 . . . . 0.0 112.303 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -74.94 -35.66 62.13 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 118.736 0.698 . . . . 0.0 112.779 173.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.0 m -64.29 -39.93 94.92 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.284 0.493 . . . . 0.0 112.051 175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.83 -34.37 73.0 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.865 -1.147 . . . . 0.0 113.513 176.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 tp -70.74 -44.67 66.33 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.563 1.545 . . . . 0.0 110.12 176.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 t -63.06 -45.07 93.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.738 0.815 . . . . 0.0 112.117 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 86.5 m -74.28 -27.92 60.96 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.347 -0.846 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 -60.67 -37.51 81.82 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 121.133 -0.979 . . . . 0.0 111.288 167.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.9 m -67.29 -21.74 65.67 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 172.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.8 mt -97.49 -5.26 36.34 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.315 1.446 . . . . 0.0 113.208 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.86 25.57 49.02 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.923 1.249 . . . . 0.0 115.924 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.74 168.78 18.89 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 118.938 1.369 . . . . 0.0 113.226 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.9 mt -83.31 143.71 30.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.034 1.334 . . . . 0.0 111.694 -175.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.38 131.9 10.73 Favored Glycine 0 N--CA 1.469 0.834 0 O-C-N 121.537 -0.727 . . . . 0.0 113.278 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -152.98 171.07 18.91 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.792 1.637 . . . . 0.0 111.219 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 64.3 m -122.29 162.03 22.22 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.261 1.424 . . . . 0.0 113.044 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.5 mm -128.16 96.79 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.13 1.772 . . . . 0.0 106.466 168.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.68 -137.93 20.86 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 109.859 -1.296 . . . . 0.0 109.859 -167.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -76.87 3.19 12.56 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 175.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -121.59 132.23 54.56 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -167.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.4 m -71.18 136.1 47.91 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.587 1.155 . . . . 0.0 113.374 -178.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -150.12 84.08 1.39 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 127.287 2.235 . . . . 0.0 109.886 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -61.62 154.27 25.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.5 m -140.53 156.86 69.19 Favored Pre-proline 0 N--CA 1.488 1.47 0 C-N-CA 126.113 1.765 . . . . 0.0 113.368 -170.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -60.27 147.2 94.56 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 123.803 3.002 . . . . 0.0 116.544 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.228 1.811 . . . . 0.0 113.684 173.77 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -65.13 137.85 57.91 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.471 0.708 . . . . 0.0 112.274 174.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.5 p -156.11 23.33 0.37 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.293 1.437 . . . . 0.0 113.324 -177.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 54.26 23.99 4.7 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.885 2.074 . . . . 0.0 115.108 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 23.7 tp -59.33 -23.89 62.88 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.644 1.178 . . . . 0.0 113.821 -172.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -53.58 -47.24 70.3 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 120.108 1.322 . . . . 0.0 111.624 172.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -71.89 -37.29 70.16 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.017 1.327 . . . . 0.0 113.581 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -64.71 -46.77 80.9 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 117.946 0.339 . . . . 0.0 111.02 174.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -58.4 -50.58 73.16 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 125.109 1.364 . . . . 0.0 112.258 175.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pp -68.21 -34.85 77.01 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.658 1.572 . . . . 0.0 112.172 -176.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.4 m -63.06 -39.38 94.56 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.08 0.552 . . . . 0.0 111.471 173.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -81.01 -33.71 33.45 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 178.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -68.33 -29.7 68.51 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.326 -1.484 . . . . 0.0 111.905 176.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.6 m -59.38 -27.34 65.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.076 0.95 . . . . 0.0 112.133 169.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -103.31 4.9 36.98 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.508 1.923 . . . . 0.0 113.322 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.04 30.59 46.27 Favored Glycine 0 CA--C 1.538 1.492 0 N-CA-C 116.843 1.497 . . . . 0.0 116.843 174.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -138.87 157.73 45.51 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 120.207 2.004 . . . . 0.0 114.446 177.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 22.9 tp -83.97 144.54 29.08 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.234 1.813 . . . . 0.0 112.305 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.13 145.55 16.29 Favored Glycine 0 CA--C 1.537 1.435 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -137.07 118.04 14.27 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.741 2.017 . . . . 0.0 110.348 169.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 p -71.33 127.23 31.87 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.096 -1.002 . . . . 0.0 110.136 169.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.0 mm -103.4 -33.9 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.206 1.002 . . . . 0.0 111.883 -169.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.2 -110.87 0.42 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.418 1.485 . . . . 0.0 111.154 -170.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -71.95 -27.43 62.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.012 1.325 . . . . 0.0 113.726 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -141.9 135.34 29.37 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.646 1.978 . . . . 0.0 111.458 178.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.8 t -80.01 149.52 30.72 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.267 1.427 . . . . 0.0 112.318 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.05 162.92 28.75 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.739 1.615 . . . . 0.0 111.257 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.6 m -132.52 151.24 51.98 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.778 0.831 . . . . 0.0 112.915 -175.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.9 m -144.78 162.36 38.86 Favored Pre-proline 0 N--CA 1.48 1.067 0 C-N-CA 126.581 1.952 . . . . 0.0 112.531 -169.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -63.99 142.37 81.16 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 123.106 2.537 . . . . 0.0 114.808 -175.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.401 1.48 . . . . 0.0 114.833 -176.223 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.889 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -63.09 137.21 58.18 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.1 m -77.85 14.02 1.2 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.509 1.524 . . . . 0.0 114.871 -178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 56.45 30.21 16.66 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 126.515 1.926 . . . . 0.0 113.107 -169.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.0 tt -57.03 -29.59 63.5 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -169.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.6 ttp85 -65.15 -45.77 83.63 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.393 1.451 . . . . 0.0 112.003 174.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -62.78 -40.62 97.88 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.735 0.814 . . . . 0.0 110.525 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.8 t -60.64 -51.72 68.2 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.32 1.448 . . . . 0.0 111.587 175.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.47 -46.78 86.94 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.37 1.068 . . . . 0.0 113.031 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pp -66.6 -33.53 75.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.941 1.701 . . . . 0.0 111.981 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.5 m -63.85 -46.45 84.95 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.238 0.615 . . . . 0.0 110.981 170.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -77.79 -30.63 51.39 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -61.0 -40.31 93.04 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.111 1.364 . . . . 0.0 110.677 167.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.9 m -67.12 -22.27 65.81 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.797 0.839 . . . . 0.0 113.014 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.72 -14.28 24.93 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.677 1.591 . . . . 0.0 113.782 173.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.79 24.66 24.89 Favored Glycine 0 CA--C 1.542 1.764 0 C-N-CA 125.981 1.753 . . . . 0.0 115.923 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.83 167.87 21.15 Favored 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 119.327 1.564 . . . . 0.0 113.865 -178.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 mt -92.17 136.24 33.35 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.849 1.26 . . . . 0.0 112.76 -170.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.37 149.31 21.84 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.057 0.837 . . . . 0.0 113.839 170.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -153.88 137.84 16.32 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.109 1.763 . . . . 0.0 112.078 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.6 t -83.24 118.18 23.46 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.171 -0.955 . . . . 0.0 110.299 169.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.6 mt -84.17 -35.3 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.824 0.85 . . . . 0.0 110.923 -175.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.8 -68.21 0.13 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 124.63 1.11 . . . . 0.0 112.67 177.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.69 -24.67 41.58 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.865 -0.786 . . . . 0.0 113.026 175.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -159.96 166.1 30.74 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.699 1.199 . . . . 0.0 112.398 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 48.1 t -96.19 133.56 40.36 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.673 1.189 . . . . 0.0 112.437 172.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -133.16 170.71 15.02 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.471 2.308 . . . . 0.0 109.05 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -126.54 154.42 43.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.2 m -146.71 152.39 44.74 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 126.615 1.966 . . . . 0.0 111.757 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -61.65 146.07 97.08 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 122.784 2.323 . . . . 0.0 113.769 176.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.351 0 C-N-CA 125.545 1.538 . . . . 0.0 111.57 169.768 . . . . . . . . 0 0 . 1 stop_ save_