data_5nda_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5nda _Structure_validation_residue.Date_analyzed 2017-06-02 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo . . . . . 0 N--CA 1.46 -0.442 0 CA-C-O 119.739 -0.192 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.53 -35.18 68.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.524 -0.735 . . . . 0.0 109.468 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -64.31 -50.04 69.42 Favored 'General case' 0 C--N 1.342 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.96 -40.08 87.81 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -59.06 -50.93 72.18 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -34.84 78.67 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.434 1.015 . . . . 0.0 111.156 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.3 tp -69.45 -31.16 69.3 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 119.244 0.929 . . . . 0.0 109.633 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -35.4 22.81 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.153 -0.967 . . . . 0.0 109.973 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.89 -46.77 83.42 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -58.08 -44.35 87.52 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.334 0.654 . . . . 0.0 109.916 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 tp -63.77 -44.32 93.75 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.4 -42.09 99.16 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.88 -44.5 95.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.337 0.655 . . . . 0.0 109.679 179.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.5 tt -57.82 -50.06 74.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.9 tp -60.61 -38.77 85.79 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.535 0.734 . . . . 0.0 111.078 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.58 -48.9 75.5 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.8 mt -61.37 -41.09 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.8 tt -59.35 -51.11 71.34 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.09 -39.93 83.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.809 1.244 . . . . 0.0 110.468 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -59.42 -52.09 67.08 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.413 1.085 . . . . 0.0 108.404 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 77.7 mt . . . . . 0 C--N 1.335 -0.064 0 C-N-CA 123.034 0.534 . . . . 0.0 109.912 179.783 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo . . . . . 0 N--CA 1.462 -0.375 0 N-CA-C 113.504 0.54 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -62.75 -33.19 58.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.416 -0.802 . . . . 0.0 109.742 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -71.56 -40.53 69.92 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -59.74 -44.0 93.97 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -62.13 -47.58 83.95 Favored 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.778 1.231 . . . . 0.0 108.978 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -58.84 -36.41 74.51 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.144 1.378 . . . . 0.0 111.372 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -73.4 -48.18 35.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.47 -36.13 79.56 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.663 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.67 -44.26 86.79 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.94 -45.22 93.31 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -58.9 -50.38 74.24 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.873 0.869 . . . . 0.0 109.674 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.1 -45.03 83.74 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.761 0.825 . . . . 0.0 110.023 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.1 mt -62.61 -43.26 99.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.5 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.42 -45.13 94.72 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 119.005 0.82 . . . . 0.0 108.983 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.6 -42.42 98.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.22 0.608 . . . . 0.0 110.059 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.55 -48.78 79.45 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 123.472 0.709 . . . . 0.0 109.422 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.73 -42.65 95.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 123.726 0.81 . . . . 0.0 109.191 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -59.41 -49.43 77.84 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 118.741 0.7 . . . . 0.0 109.529 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 61.8 tp -59.85 -39.75 86.25 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.322 1.049 . . . . 0.0 110.125 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.65 -52.13 66.43 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.651 1.18 . . . . 0.0 108.418 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.0 mt . . . . . 0 N--CA 1.46 0.071 0 C-N-CA 123.372 0.669 . . . . 0.0 109.865 179.691 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo . . . . . 0 N--CA 1.459 -0.502 0 CA-C-O 119.734 -0.194 . . . . 0.0 112.103 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.01 -31.98 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 O-C-N 121.429 -0.794 . . . . 0.0 110.44 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -71.16 -39.81 71.69 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.014 1.279 . . . . 0.0 107.862 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.79 -43.07 99.76 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -62.13 -46.79 87.43 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.86 1.264 . . . . 0.0 108.698 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -57.3 -36.78 71.49 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.006 1.722 . . . . 0.0 111.231 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.7 tp -72.64 -49.79 29.51 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -35.77 73.6 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 118.933 -0.556 . . . . 0.0 111.475 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.7 tp -67.77 -43.42 79.85 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.322 1.049 . . . . 0.0 109.255 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -61.67 -47.44 85.36 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.1 mt -63.29 -42.6 99.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.903 0.481 . . . . 0.0 110.229 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.63 -45.5 93.81 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.85 -42.56 99.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.696 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.5 -53.42 57.67 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.78 -44.18 94.03 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.774 0.83 . . . . 0.0 110.849 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.34 -49.64 76.8 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.204 0.602 . . . . 0.0 110.743 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.9 mm -64.47 -38.72 83.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.3 tp -60.69 -49.41 77.61 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.82 -41.96 92.43 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.997 1.319 . . . . 0.0 109.821 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 tt -59.29 -52.32 66.18 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 124.392 1.077 . . . . 0.0 108.622 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 89.5 mt . . . . . 0 CA--C 1.529 0.16 0 C-N-CA 123.601 0.76 . . . . 0.0 110.655 -179.842 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 N--CA 1.46 -0.499 0 CA-C-O 119.564 -0.265 . . . . 0.0 112.575 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.66 -29.68 47.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 121.363 -0.835 . . . . 0.0 110.791 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -69.8 -49.08 56.23 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.64 -42.76 84.07 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -60.82 -47.05 88.12 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.239 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 -58.57 -36.97 74.77 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 119.662 1.119 . . . . 0.0 111.657 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -71.61 -48.13 50.05 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.39 -33.22 75.06 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.642 -0.694 . . . . 0.0 111.913 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.0 tp -67.46 -48.81 66.12 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.28 -48.48 80.34 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.272 0.629 . . . . 0.0 109.308 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.4 tp -59.51 -46.69 88.12 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.568 0.747 . . . . 0.0 110.684 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.89 -44.89 95.88 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.11 0.414 . . . . 0.0 110.573 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.74 -43.72 95.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.208 0.458 . . . . 0.0 110.365 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.1 tp -59.88 -47.08 87.2 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.95 -41.13 95.71 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.644 0.778 . . . . 0.0 110.473 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.42 -50.67 70.57 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -61.67 -40.89 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.94 -52.2 66.77 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.02 -40.22 80.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.675 1.19 . . . . 0.0 110.556 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.44 -57.01 14.84 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.424 1.09 . . . . 0.0 108.879 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.8 mm . . . . . 0 CA--C 1.528 0.131 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.997 -179.748 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo . . . . . 0 N--CA 1.46 -0.486 0 CA-C-O 119.222 -0.407 . . . . 0.0 112.965 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.8 t -62.11 -44.6 99.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -41.06 97.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.11 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.89 -44.28 94.32 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.5 tptp -58.9 -51.24 70.89 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.384 1.074 . . . . 0.0 108.596 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -35.93 75.4 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 124.679 1.192 . . . . 0.0 111.605 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.7 mt -73.39 -27.17 61.32 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 119.057 0.844 . . . . 0.0 109.909 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -38.97 18.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.033 -1.042 . . . . 0.0 109.908 178.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.71 -47.57 85.69 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.554 1.542 . . . . 0.0 108.491 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -54.98 -41.19 70.87 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 122.79 0.436 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -71.32 -43.0 67.88 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.622 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.79 -41.96 96.61 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 118.164 0.438 . . . . 0.0 110.023 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tt -64.96 -45.45 85.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.591 1.156 . . . . 0.0 110.062 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.9 tp -60.51 -45.43 93.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.09 -39.66 93.22 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.404 0.681 . . . . 0.0 110.452 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.51 -48.01 81.43 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 118.861 0.755 . . . . 0.0 109.173 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.7 mt -60.68 -45.04 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -57.87 -50.96 71.54 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.778 0.831 . . . . 0.0 109.539 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.15 -42.06 85.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.747 1.219 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.55 -47.06 83.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.073 0.549 . . . . 0.0 109.693 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.5 mt . . . . . 0 N--CA 1.462 0.155 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.72 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 N--CA 1.46 -0.47 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.8 m -63.15 -35.43 71.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 119.153 0.888 . . . . 0.0 110.96 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 -70.44 -46.78 63.22 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.52 -44.07 80.43 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.7 tptt -59.42 -51.8 68.33 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.799 0.84 . . . . 0.0 108.799 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -60.21 -34.75 74.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.137 0.881 . . . . 0.0 111.87 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mp -70.6 -28.27 64.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 119.529 1.058 . . . . 0.0 109.666 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -40.06 16.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.138 -0.976 . . . . 0.0 109.983 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.1 tp -60.8 -43.67 97.86 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.92 1.288 . . . . 0.0 108.837 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.69 -41.06 80.86 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.887 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.0 mt -69.62 -43.79 71.98 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.161 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.13 -43.5 95.64 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 118.076 0.398 . . . . 0.0 109.947 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 tp -65.2 -44.34 88.68 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.889 0.875 . . . . 0.0 110.3 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.2 tp -59.77 -45.17 93.07 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 tt -62.01 -42.21 98.91 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.374 0.67 . . . . 0.0 109.981 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 tp -62.3 -46.65 87.78 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.486 0.584 . . . . 0.0 109.893 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.9 mt -63.9 -41.57 92.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.06 -49.52 77.57 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.931 0.787 . . . . 0.0 109.086 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.88 -42.39 84.5 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.894 1.278 . . . . 0.0 109.814 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -59.48 -55.44 34.59 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.741 1.216 . . . . 0.0 108.774 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 47.1 mm . . . . . 0 CA--C 1.532 0.267 0 C-N-CA 123.645 0.778 . . . . 0.0 110.967 -179.961 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo . . . . . 0 N--CA 1.462 -0.345 0 N-CA-C 114.99 1.112 . . . . 0.0 114.99 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 37.3 t -61.66 -34.33 61.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 119.416 1.007 . . . . 0.0 109.289 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -66.85 -46.5 74.85 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.07 -42.19 89.8 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -61.52 -47.52 85.22 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.28 68.65 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 119.616 1.098 . . . . 0.0 112.244 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 tt -70.89 -51.29 27.13 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -34.68 76.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.557 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.2 tp -66.35 -44.9 81.94 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 124.238 1.015 . . . . 0.0 108.886 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.57 -45.91 90.46 Favored 'General case' 0 C--O 1.227 -0.123 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.94 -43.79 98.12 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.52 -38.07 88.52 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 119.043 -0.504 . . . . 0.0 110.325 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -64.32 -47.84 77.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.1 mt -58.11 -44.67 87.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.2 tp -62.26 -39.52 93.14 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.105 0.562 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.2 -46.45 83.85 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.801 0.728 . . . . 0.0 109.62 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.2 mm -63.93 -40.48 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.8 tp -59.71 -49.69 76.75 Favored 'General case' 0 C--O 1.226 -0.132 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 tt -58.64 -39.52 80.77 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.925 1.29 . . . . 0.0 110.402 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.1 tt -59.5 -54.11 50.36 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.341 1.056 . . . . 0.0 108.459 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 CA--C 1.528 0.127 0 CA-C-O 119.512 -0.28 . . . . 0.0 110.55 179.821 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo . . . . . 0 CA--C 1.534 0.477 0 N-CA-C 115.719 1.392 . . . . 0.0 115.719 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.42 -31.25 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 118.981 0.81 . . . . 0.0 110.621 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -69.82 -48.89 57.35 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.3 mp -55.1 -44.71 75.16 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.95 -53.74 53.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.8 mtt-85 -59.66 -33.75 71.94 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.293 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.36 -25.23 61.44 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 120.074 1.306 . . . . 0.0 109.708 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -40.33 17.77 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.019 -1.051 . . . . 0.0 108.875 177.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.4 tp -65.92 -52.28 51.31 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.799 0.84 . . . . 0.0 109.875 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.74 -44.33 90.46 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 123.175 0.59 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.32 -33.17 71.19 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.573 -0.851 . . . . 0.0 111.346 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.6 tp -67.51 -42.86 82.16 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.78 -45.75 91.2 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.036 0.934 . . . . 0.0 109.099 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.1 tp -60.14 -43.66 95.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.21 -38.63 89.88 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.129 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.37 -43.99 92.79 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.102 0.864 . . . . 0.0 109.146 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.68 -45.52 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.14 -46.89 82.32 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.651 0.78 . . . . 0.0 110.349 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -56.36 -43.94 79.63 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.903 1.281 . . . . 0.0 110.158 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.96 -47.27 72.15 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 CA--C 1.532 0.261 0 C-N-CA 125.0 1.32 . . . . 0.0 110.873 179.409 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 CA--C 1.533 0.461 0 N-CA-C 110.167 -0.744 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.0 m -65.04 -32.84 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 O-C-N 121.808 -0.557 . . . . 0.0 109.772 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -70.42 -41.81 72.42 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.304 0.956 . . . . 0.0 108.986 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.6 mt -60.16 -41.15 92.19 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -61.68 -51.75 67.13 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.974 0.909 . . . . 0.0 108.554 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 -58.85 -36.79 75.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.498 1.519 . . . . 0.0 111.682 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.12 -39.4 72.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -42.5 90.22 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.31 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 tt -62.17 -55.38 29.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 124.025 0.93 . . . . 0.0 108.75 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -55.8 -44.95 78.28 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 123.918 0.887 . . . . 0.0 111.353 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.9 mt -68.45 -37.85 80.58 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.512 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.4 mt -66.78 -42.19 86.43 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.5 tp -63.72 -44.04 94.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.217 0.607 . . . . 0.0 109.705 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.04 -46.43 88.25 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 tp -62.03 -40.93 97.38 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 119.057 -0.497 . . . . 0.0 110.378 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 tt -62.31 -49.26 76.35 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 30.0 mm -60.49 -43.96 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 tt -58.69 -50.62 73.22 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.592 0.757 . . . . 0.0 109.345 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.35 -42.36 86.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 124.529 1.132 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.2 -46.89 81.93 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.315 0.646 . . . . 0.0 109.717 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.9 mt . . . . . 0 N--CA 1.46 0.06 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.977 179.788 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo . . . . . 0 CA--C 1.531 0.367 0 N-CA-C 111.251 -0.327 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.5 -32.88 60.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.631 -0.668 . . . . 0.0 111.018 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -71.97 -41.0 68.23 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.833 1.197 . . . . 0.0 108.831 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 75.4 mt -61.21 -41.47 96.9 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 177.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.9 tptp -62.27 -49.12 76.95 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.604 1.161 . . . . 0.0 109.434 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -60.14 -35.76 76.01 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.436 1.095 . . . . 0.0 110.84 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.5 mt -70.44 -45.7 65.3 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.23 -35.6 81.34 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.781 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -66.4 -45.78 78.83 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.29 -46.63 88.03 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.655 0.782 . . . . 0.0 109.263 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.33 -40.7 97.22 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.062 -0.494 . . . . 0.0 110.353 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.3 tt -63.4 -45.53 90.59 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.8 -43.44 98.79 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.019 0.528 . . . . 0.0 109.957 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.6 tp -60.27 -44.37 95.39 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.7 tt -62.2 -41.37 98.3 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 123.316 0.647 . . . . 0.0 109.796 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.0 tt -63.11 -43.84 97.32 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.65 0.659 . . . . 0.0 109.775 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.7 mt -63.75 -44.8 98.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.15 -48.97 79.65 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.655 0.782 . . . . 0.0 109.245 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.1 tt -55.65 -43.99 76.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.193 1.397 . . . . 0.0 111.089 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 19.2 mt -64.94 -45.12 87.09 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 123.694 0.798 . . . . 0.0 109.358 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.0 mt . . . . . 0 N--CA 1.462 0.136 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.466 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo . . . . . 0 CA--C 1.533 0.434 0 N-CA-C 111.136 -0.371 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -63.4 -27.74 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.51 0.724 . . . . 0.0 110.842 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -69.81 -51.16 36.03 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.92 -41.97 79.13 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -62.86 -47.72 82.14 Favored 'General case' 0 C--N 1.341 0.239 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.78 -40.86 85.21 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.127 0.876 . . . . 0.0 111.701 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.75 -25.83 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 118.879 0.763 . . . . 0.0 110.471 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.8 -40.75 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.348 -0.834 . . . . 0.0 109.932 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.3 tp -64.1 -47.77 78.74 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.909 0.884 . . . . 0.0 109.197 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.6 -43.83 89.69 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.52 -43.45 97.11 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-O 119.093 -0.48 . . . . 0.0 110.348 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.53 -48.51 81.45 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 122.909 0.484 . . . . 0.0 109.727 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.91 -45.01 94.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 119.257 -0.402 . . . . 0.0 110.833 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.14 -46.93 84.79 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.91 -41.33 97.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.564 0.746 . . . . 0.0 110.507 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.1 -50.38 72.14 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.944 0.793 . . . . 0.0 109.948 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 mm -62.65 -43.76 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.48 -49.61 76.72 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 123.269 0.627 . . . . 0.0 109.968 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.3 tp -56.65 -43.12 80.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.335 1.454 . . . . 0.0 111.437 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.8 mt -63.63 -47.59 80.74 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.74 0.816 . . . . 0.0 109.079 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 42.6 mm . . . . . 0 CA--C 1.531 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.185 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo . . . . . 0 N--CA 1.46 -0.494 0 N-CA-C 112.936 0.321 . . . . 0.0 112.936 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -63.49 -31.14 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.36 -0.838 . . . . 0.0 110.538 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -69.22 -46.66 66.85 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.67 -41.91 91.68 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -61.93 -48.5 80.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 118.197 -0.906 . . . . 0.0 108.94 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtt180 -60.15 -30.45 69.32 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.664 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.77 -50.83 39.45 Favored 'General case' 0 C--O 1.226 -0.183 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -36.36 82.34 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.41 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.25 -44.55 83.4 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -58.95 -45.28 90.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -63.05 -41.89 99.59 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.35 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 tt -61.94 -47.27 85.64 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.016 0.526 . . . . 0.0 109.656 179.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 80.5 mt -63.13 -42.11 99.43 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.342 0.657 . . . . 0.0 110.358 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.4 tp -60.62 -47.06 87.92 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -61.26 -40.72 95.13 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 123.475 0.71 . . . . 0.0 110.178 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.1 tt -61.56 -49.19 77.65 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.61 -42.1 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.84 -49.73 76.65 Favored 'General case' 0 C--O 1.226 -0.175 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.8 tp -60.69 -36.38 78.63 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.445 1.098 . . . . 0.0 110.504 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.53 -54.87 37.52 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 179.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.0 mm . . . . . 0 C--O 1.226 -0.155 0 CA-C-O 119.191 -0.433 . . . . 0.0 110.668 179.954 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo . . . . . 0 N--CA 1.461 -0.41 0 N-CA-C 114.0 0.731 . . . . 0.0 114.0 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.76 -35.39 67.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-N 119.145 0.884 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -67.36 -47.3 70.83 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 179.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -57.15 -43.73 82.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.2 -50.51 73.39 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 123.78 0.832 . . . . 0.0 108.865 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -40.35 78.02 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.823 1.249 . . . . 0.0 112.036 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.96 -26.8 61.49 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 124.235 1.014 . . . . 0.0 110.412 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.38 -38.39 20.34 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.247 -0.908 . . . . 0.0 109.453 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.5 tp -64.04 -45.79 87.27 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 124.223 1.009 . . . . 0.0 108.386 178.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.64 -44.76 93.39 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.5 tp -63.36 -43.72 96.85 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.506 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.32 -48.44 81.73 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.02 0.528 . . . . 0.0 109.703 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.2 tp -62.92 -43.16 99.55 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.759 0.424 . . . . 0.0 110.924 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -59.86 -47.24 86.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.3 tp -62.37 -39.71 94.07 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.203 0.601 . . . . 0.0 110.605 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.59 -48.49 79.21 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.574 0.625 . . . . 0.0 109.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.8 -41.04 91.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.8 tp -58.81 -50.39 74.14 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.05 -40.59 85.56 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 0.0 110.236 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -58.83 -56.3 24.02 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.538 1.135 . . . . 0.0 108.955 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.2 mm . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 119.098 -0.477 . . . . 0.0 110.685 -179.735 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo . . . . . 0 N--CA 1.462 -0.335 0 N-CA-C 113.859 0.676 . . . . 0.0 113.859 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.72 -29.8 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 121.4 -0.813 . . . . 0.0 110.114 178.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -69.85 -42.1 74.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.745 1.157 . . . . 0.0 108.311 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.92 -41.33 99.44 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -63.81 -47.54 80.42 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 124.649 1.18 . . . . 0.0 108.51 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -57.55 -35.27 70.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.628 1.971 . . . . 0.0 111.38 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -72.29 -48.86 39.12 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -36.94 81.76 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.924 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -64.97 -44.42 89.42 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 124.166 0.986 . . . . 0.0 108.427 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.86 -44.97 93.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.59 -49.35 75.58 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.889 0.476 . . . . 0.0 110.363 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.9 -38.41 88.26 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.545 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.8 tp -65.14 -43.74 90.91 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.744 0.702 . . . . 0.0 109.703 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -60.72 -45.87 92.58 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.1 tp -61.85 -40.5 95.57 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.034 0.534 . . . . 0.0 110.321 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.66 -47.22 84.63 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 77.8 mt -61.9 -41.98 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.44 -49.67 76.91 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 118.819 0.736 . . . . 0.0 109.337 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.75 -42.37 88.69 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.53 1.132 . . . . 0.0 110.118 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -58.87 -51.56 69.51 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 125.11 1.364 . . . . 0.0 108.637 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.9 mt . . . . . 0 C--N 1.335 -0.049 0 C-N-CA 123.175 0.59 . . . . 0.0 110.179 179.819 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo . . . . . 0 N--CA 1.458 -0.601 0 N-CA-C 114.133 0.782 . . . . 0.0 114.133 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.9 m -63.05 -36.67 76.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 119.363 0.983 . . . . 0.0 111.193 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -71.21 -44.62 65.03 Favored 'General case' 0 C--N 1.339 0.119 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.0 mt -57.75 -43.86 85.71 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.06 -51.5 69.37 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.083 0.953 . . . . 0.0 108.528 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.8 mtp180 -59.97 -34.51 73.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.168 0.894 . . . . 0.0 112.168 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 mt -72.06 -29.23 63.94 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.619 1.099 . . . . 0.0 109.65 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -36.07 21.38 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.008 -1.058 . . . . 0.0 110.255 178.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -64.84 -44.99 88.0 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.651 1.181 . . . . 0.0 108.787 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.34 -41.96 85.76 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 122.827 0.451 . . . . 0.0 109.971 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.19 -46.38 80.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.78 -44.75 96.38 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.76 -43.17 99.38 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.741 0.817 . . . . 0.0 110.321 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.5 tp -59.32 -46.5 88.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.01 -41.41 98.05 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.932 0.493 . . . . 0.0 110.146 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.92 -49.37 76.43 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 123.564 0.746 . . . . 0.0 109.409 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.5 mm -61.87 -40.36 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.91 -47.54 85.91 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.037 0.835 . . . . 0.0 109.246 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.86 -37.38 81.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.424 1.09 . . . . 0.0 110.081 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.11 -50.84 68.9 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.553 1.141 . . . . 0.0 108.12 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.5 mt . . . . . 0 CA--C 1.53 0.19 0 C-N-CA 123.696 0.798 . . . . 0.0 109.821 179.504 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo . . . . . 0 CA--C 1.531 0.369 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.6 m -63.66 -33.28 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.45 -0.781 . . . . 0.0 109.943 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -72.47 -40.67 66.77 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 119.417 1.008 . . . . 0.0 108.581 178.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.83 -44.59 90.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -61.37 -47.3 86.47 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 124.224 1.01 . . . . 0.0 109.602 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.3 mtp85 -57.89 -34.83 70.22 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 119.68 1.127 . . . . 0.0 111.76 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 mp -71.26 -46.75 60.26 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 119.991 1.269 . . . . 0.0 107.666 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -34.23 77.63 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.986 -0.53 . . . . 0.0 111.253 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.0 tp -67.75 -44.47 77.46 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.053 0.941 . . . . 0.0 108.818 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.92 -45.66 91.88 Favored 'General case' 0 C--O 1.226 -0.151 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.21 -48.11 83.03 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.124 0.57 . . . . 0.0 109.825 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.55 -44.64 93.19 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.36 0.664 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.9 tt -60.6 -43.43 97.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.107 0.963 . . . . 0.0 110.549 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -58.8 -51.46 69.89 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.4 tt -59.96 -40.05 87.69 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.792 0.837 . . . . 0.0 110.633 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -63.6 -43.91 95.52 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.381 0.672 . . . . 0.0 110.117 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.51 -42.87 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.25 -48.8 80.27 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.28 -37.69 78.29 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.084 1.354 . . . . 0.0 110.664 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 tt -59.74 -52.04 67.18 Favored 'General case' 0 C--O 1.23 0.061 0 C-N-CA 124.727 1.211 . . . . 0.0 108.546 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 48.3 mm . . . . . 0 C--O 1.231 0.12 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 179.599 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 N--CA 1.462 -0.378 0 N-CA-C 114.603 0.963 . . . . 0.0 114.603 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -60.58 -30.53 46.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 119.311 0.96 . . . . 0.0 111.001 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -66.68 -50.11 63.93 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 79.0 mt -59.16 -41.84 89.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -60.86 -48.5 81.54 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.293 1.037 . . . . 0.0 109.9 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -62.2 -35.94 80.41 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 119.438 1.017 . . . . 0.0 110.962 179.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 69.1 mt -70.46 -44.81 67.01 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.427 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -64.23 -39.55 94.2 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.646 -0.692 . . . . 0.0 110.182 178.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.1 tp -63.1 -48.96 76.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.705 0.802 . . . . 0.0 109.258 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -57.91 -45.23 86.8 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.321 0.648 . . . . 0.0 109.908 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.7 mt -64.58 -42.58 95.53 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.77 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.02 -39.13 92.95 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.502 0.592 . . . . 0.0 109.905 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.2 tp -65.05 -44.12 90.05 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.1 tp -59.58 -45.58 91.45 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.3 -43.39 98.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.452 0.701 . . . . 0.0 109.813 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.47 -49.33 77.97 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-N 118.652 0.66 . . . . 0.0 109.571 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.0 mm -62.74 -39.43 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.0 tp -61.48 -47.91 83.5 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.161 0.891 . . . . 0.0 109.101 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.48 -40.08 85.83 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.977 1.311 . . . . 0.0 109.443 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -61.63 -51.19 69.49 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 124.633 1.173 . . . . 0.0 110.912 179.643 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 N--CA 1.462 -0.381 0 N-CA-C 113.657 0.599 . . . . 0.0 113.657 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.4 t -68.65 -39.02 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.9 m80 -67.78 -38.31 83.2 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 119.092 0.86 . . . . 0.0 109.364 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.5 mt -58.48 -45.27 89.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -52.74 64.46 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.327 1.051 . . . . 0.0 108.851 177.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -55.27 -34.4 64.03 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.785 1.234 . . . . 0.0 112.577 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mp -73.27 -27.52 61.61 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 119.376 0.989 . . . . 0.0 109.86 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.45 -39.5 18.88 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 120.944 -1.097 . . . . 0.0 109.485 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.2 tp -60.74 -41.28 95.06 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 124.947 1.299 . . . . 0.0 108.614 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.82 -41.73 82.82 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.7 mt -71.7 -39.61 70.08 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.13 -37.44 80.06 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 tt -62.93 -48.85 77.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.233 1.013 . . . . 0.0 108.657 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.02 -43.45 86.75 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.4 tp -63.44 -38.24 90.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.066 0.546 . . . . 0.0 110.417 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.8 tp -63.88 -45.15 90.71 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 118.771 0.714 . . . . 0.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.1 mm -63.99 -40.98 91.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.32 -49.1 79.11 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.73 -41.43 86.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.787 1.235 . . . . 0.0 110.265 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.48 -52.09 67.1 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.688 1.195 . . . . 0.0 108.606 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.2 mt . . . . . 0 C--O 1.228 -0.065 0 C-N-CA 123.303 0.641 . . . . 0.0 110.134 179.724 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo . . . . . 0 N--CA 1.456 -0.696 0 CA-C-O 119.091 -0.462 . . . . 0.0 111.838 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.8 t -65.18 -43.74 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -65.34 -44.38 87.93 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.15 -44.22 87.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -59.66 -49.15 78.87 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 178.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.5 84.63 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.767 0.827 . . . . 0.0 112.223 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -74.56 -25.17 59.13 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.921 0.889 . . . . 0.0 110.965 -178.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -38.73 20.05 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 tp -62.88 -46.9 85.67 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.39 -42.76 87.82 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.241 0.616 . . . . 0.0 110.54 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 64.4 tp -64.85 -47.4 78.07 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.032 0.378 . . . . 0.0 110.49 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.21 -42.68 99.53 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.31 -42.98 99.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.285 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.6 tp -58.58 -47.37 84.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.5 tp -62.14 -42.16 98.97 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.642 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.15 -46.34 87.62 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.806 0.442 . . . . 0.0 110.284 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 22.3 mm -62.11 -43.1 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.85 -51.36 70.36 Favored 'General case' 0 N--CA 1.461 0.112 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.33 -43.37 83.3 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.355 1.062 . . . . 0.0 110.868 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.63 -46.05 87.46 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.082 0.553 . . . . 0.0 110.061 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.4 mt . . . . . 0 N--CA 1.461 0.08 0 C-N-CA 123.182 0.593 . . . . 0.0 110.077 179.73 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo . . . . . 0 N--CA 1.454 -0.83 0 N-CA-C 110.569 -0.589 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.7 t -64.59 -48.37 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 123.931 0.892 . . . . 0.0 108.837 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -65.75 -38.18 88.38 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.485 1.038 . . . . 0.0 109.147 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.39 -43.8 98.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -62.77 -47.59 82.84 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.55 1.14 . . . . 0.0 108.292 178.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.3 tpm_? -56.63 -39.32 73.46 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.865 1.666 . . . . 0.0 111.266 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.76 -46.37 58.64 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -38.55 86.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.269 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.5 tp -66.4 -43.65 85.23 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.666 1.186 . . . . 0.0 109.402 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.56 -46.52 89.87 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.9 mt -63.84 -40.12 95.82 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.529 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.0 -46.75 87.85 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.428 0.558 . . . . 0.0 109.856 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.32 -42.44 98.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.193 0.452 . . . . 0.0 110.338 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -60.16 -47.01 87.72 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 tt -60.82 -41.09 95.07 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 123.841 0.856 . . . . 0.0 110.41 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.16 -49.18 76.88 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 118.481 0.582 . . . . 0.0 109.868 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.0 mm -64.11 -38.48 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.98 -49.44 77.43 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.09 -39.79 83.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.902 1.281 . . . . 0.0 109.933 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -61.26 -53.46 56.52 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.53 0.177 0 C-N-CA 123.817 0.847 . . . . 0.0 110.935 -179.598 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.8 tt . . . . . 0 N--CA 1.474 0.727 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -68.33 168.79 18.48 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 CA-C-N 120.857 1.342 . . . . 0.0 109.513 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 p -134.09 119.6 19.12 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -54.82 141.46 57.48 Favored Pre-proline 0 CA--C 1.539 0.521 0 C-N-CA 123.171 0.588 . . . . 0.0 110.046 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -61.12 -24.28 78.96 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.301 2.001 . . . . 0.0 112.543 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.53 -35.18 68.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.524 -0.735 . . . . 0.0 109.468 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -64.31 -50.04 69.42 Favored 'General case' 0 C--N 1.342 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.96 -40.08 87.81 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -59.06 -50.93 72.18 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -34.84 78.67 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.434 1.015 . . . . 0.0 111.156 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.3 tp -69.45 -31.16 69.3 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 119.244 0.929 . . . . 0.0 109.633 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -35.4 22.81 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.153 -0.967 . . . . 0.0 109.973 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.89 -46.77 83.42 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -58.08 -44.35 87.52 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.334 0.654 . . . . 0.0 109.916 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 tp -63.77 -44.32 93.75 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.4 -42.09 99.16 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.88 -44.5 95.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.337 0.655 . . . . 0.0 109.679 179.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.5 tt -57.82 -50.06 74.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.9 tp -60.61 -38.77 85.79 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.535 0.734 . . . . 0.0 111.078 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.58 -48.9 75.5 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.8 mt -61.37 -41.09 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.8 tt -59.35 -51.11 71.34 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.09 -39.93 83.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.809 1.244 . . . . 0.0 110.468 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -59.42 -52.09 67.08 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.413 1.085 . . . . 0.0 108.404 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 77.7 mt -64.72 -35.44 74.93 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.064 0 C-N-CA 123.034 0.534 . . . . 0.0 109.912 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.1 tp -64.77 -14.24 58.21 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.848 0.749 . . . . 0.0 109.304 177.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.89 -47.13 5.43 Favored Glycine 0 C--N 1.34 0.766 0 N-CA-C 107.307 -2.317 . . . . 0.0 107.307 178.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.57 74.24 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.123 0.969 . . . . 0.0 109.106 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.78 -29.17 62.38 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.925 1.29 . . . . 0.0 110.662 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.7 mt -69.83 -24.44 63.45 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.59 -0.694 . . . . 0.0 111.005 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.9 mt -89.78 -29.14 18.87 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 125.208 1.403 . . . . 0.0 109.094 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 107.42 -3.76 34.87 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 125.863 1.697 . . . . 0.0 113.027 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.2 tp . . . . . 0 C--O 1.25 1.12 0 CA-C-O 116.264 -1.827 . . . . 0.0 106.215 179.632 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 70.9 mt . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 105.11 -2.181 . . . . 0.0 105.11 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -75.54 45.99 1.55 Allowed 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.889 3.059 . . . . 0.0 111.868 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.2 m -61.63 -39.34 90.97 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.118 1.367 . . . . 0.0 113.887 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -59.92 135.18 90.09 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.145 0.578 . . . . 0.0 109.84 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -58.45 -25.49 73.94 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.706 2.271 . . . . 0.0 113.504 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -62.75 -33.19 58.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.416 -0.802 . . . . 0.0 109.742 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -71.56 -40.53 69.92 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -59.74 -44.0 93.97 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -62.13 -47.58 83.95 Favored 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.778 1.231 . . . . 0.0 108.978 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -58.84 -36.41 74.51 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.144 1.378 . . . . 0.0 111.372 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -73.4 -48.18 35.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.47 -36.13 79.56 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.663 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.67 -44.26 86.79 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.94 -45.22 93.31 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -58.9 -50.38 74.24 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.873 0.869 . . . . 0.0 109.674 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.1 -45.03 83.74 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.761 0.825 . . . . 0.0 110.023 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.1 mt -62.61 -43.26 99.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.5 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.42 -45.13 94.72 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 119.005 0.82 . . . . 0.0 108.983 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.6 -42.42 98.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.22 0.608 . . . . 0.0 110.059 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.55 -48.78 79.45 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 123.472 0.709 . . . . 0.0 109.422 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.73 -42.65 95.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 123.726 0.81 . . . . 0.0 109.191 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -59.41 -49.43 77.84 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 118.741 0.7 . . . . 0.0 109.529 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 61.8 tp -59.85 -39.75 86.25 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.322 1.049 . . . . 0.0 110.125 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.65 -52.13 66.43 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.651 1.18 . . . . 0.0 108.418 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.0 mt -62.56 -32.59 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.071 0 C-N-CA 123.372 0.669 . . . . 0.0 109.865 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -14.77 51.18 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.969 0.804 . . . . 0.0 110.227 178.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.86 -38.92 10.86 Favored Glycine 0 C--N 1.34 0.792 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.4 -45.04 66.75 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 52.0 tp -59.57 -27.31 66.14 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.605 1.162 . . . . 0.0 110.939 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.88 -31.07 72.13 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.522 1.129 . . . . 0.0 110.088 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.9 tp -93.65 -29.2 15.57 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.04 1.336 . . . . 0.0 109.728 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 108.39 50.45 0.76 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.332 1.444 . . . . 0.0 111.346 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.0 tt . . . . . 0 C--O 1.246 0.872 0 C-N-CA 125.955 1.702 . . . . 0.0 107.113 179.487 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 25.6 pt . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 117.478 -1.248 . . . . 0.0 107.778 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -76.99 72.83 5.68 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.399 2.732 . . . . 0.0 111.324 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.3 p -152.68 129.21 10.71 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -58.89 141.95 85.14 Favored Pre-proline 0 C--O 1.239 0.511 0 C-N-CA 123.713 0.805 . . . . 0.0 110.961 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -61.67 -26.34 79.99 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.473 2.115 . . . . 0.0 112.103 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.01 -31.98 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 O-C-N 121.429 -0.794 . . . . 0.0 110.44 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -71.16 -39.81 71.69 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.014 1.279 . . . . 0.0 107.862 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.79 -43.07 99.76 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -62.13 -46.79 87.43 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.86 1.264 . . . . 0.0 108.698 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -57.3 -36.78 71.49 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.006 1.722 . . . . 0.0 111.231 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.7 tp -72.64 -49.79 29.51 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -35.77 73.6 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 118.933 -0.556 . . . . 0.0 111.475 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.7 tp -67.77 -43.42 79.85 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.322 1.049 . . . . 0.0 109.255 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -61.67 -47.44 85.36 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.1 mt -63.29 -42.6 99.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.903 0.481 . . . . 0.0 110.229 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.63 -45.5 93.81 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.85 -42.56 99.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.696 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.5 -53.42 57.67 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.78 -44.18 94.03 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.774 0.83 . . . . 0.0 110.849 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.34 -49.64 76.8 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.204 0.602 . . . . 0.0 110.743 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.9 mm -64.47 -38.72 83.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.3 tp -60.69 -49.41 77.61 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.82 -41.96 92.43 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.997 1.319 . . . . 0.0 109.821 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 tt -59.29 -52.32 66.18 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 124.392 1.077 . . . . 0.0 108.622 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 89.5 mt -63.7 -30.63 50.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 123.601 0.76 . . . . 0.0 110.655 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.6 tt -63.92 -16.56 61.76 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.249 0.931 . . . . 0.0 108.842 177.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -67.5 -35.63 87.09 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.37 -48.04 79.56 Favored 'General case' 0 C--O 1.224 -0.244 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.26 -32.42 72.23 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.54 -0.725 . . . . 0.0 110.945 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -79.33 -14.15 59.18 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.061 1.744 . . . . 0.0 112.867 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 96.9 mt -115.75 -29.04 6.54 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.869 1.213 . . . . 0.0 112.989 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 114.82 -14.76 19.55 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 126.468 1.985 . . . . 0.0 112.068 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.252 1.209 0 C-N-CA 127.468 2.307 . . . . 0.0 105.476 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 36.5 mm . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -64.0 -36.87 46.53 Favored 'Trans proline' 0 CA--C 1.533 0.469 0 C-N-CA 122.146 1.897 . . . . 0.0 111.963 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.7 m 51.93 21.45 1.48 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.01 140.32 9.0 Favored Pre-proline 0 C--O 1.239 0.506 0 C-N-CA 125.443 1.497 . . . . 0.0 111.526 -179.246 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.07 -29.86 88.39 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.516 2.144 . . . . 0.0 112.575 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.66 -29.68 47.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 121.363 -0.835 . . . . 0.0 110.791 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -69.8 -49.08 56.23 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.64 -42.76 84.07 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -60.82 -47.05 88.12 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.239 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 -58.57 -36.97 74.77 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 119.662 1.119 . . . . 0.0 111.657 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -71.61 -48.13 50.05 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.39 -33.22 75.06 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.642 -0.694 . . . . 0.0 111.913 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.0 tp -67.46 -48.81 66.12 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.28 -48.48 80.34 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.272 0.629 . . . . 0.0 109.308 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.4 tp -59.51 -46.69 88.12 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.568 0.747 . . . . 0.0 110.684 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.89 -44.89 95.88 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.11 0.414 . . . . 0.0 110.573 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.74 -43.72 95.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.208 0.458 . . . . 0.0 110.365 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.1 tp -59.88 -47.08 87.2 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.95 -41.13 95.71 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.644 0.778 . . . . 0.0 110.473 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.42 -50.67 70.57 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -61.67 -40.89 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.94 -52.2 66.77 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.02 -40.22 80.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.675 1.19 . . . . 0.0 110.556 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.44 -57.01 14.84 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.424 1.09 . . . . 0.0 108.879 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.8 mm -65.4 -28.43 44.39 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.997 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 46.2 tp -64.36 -17.16 63.46 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.068 0.849 . . . . 0.0 109.061 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.9 -49.82 5.85 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.83 -41.29 82.0 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.929 0.892 . . . . 0.0 109.761 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 67.1 mt -62.36 -15.29 47.61 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.746 0.818 . . . . 0.0 112.688 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 93.4 mt -102.36 -4.97 24.72 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.711 1.205 . . . . 0.0 111.434 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.8 tt -117.02 -29.54 5.94 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.524 1.13 . . . . 0.0 111.714 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 102.7 -5.1 50.76 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 125.38 1.467 . . . . 0.0 112.99 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 C--O 1.252 1.236 0 C-N-CA 127.812 2.445 . . . . 0.0 105.715 179.412 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 79.5 mt . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -62.37 -46.63 11.68 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.24 1.96 . . . . 0.0 111.724 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 t 49.5 13.35 0.08 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.67 1.988 . . . . 0.0 116.227 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.94 138.0 55.15 Favored Pre-proline 0 CA--C 1.538 0.49 0 C-N-CA 125.108 1.363 . . . . 0.0 110.528 -179.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -56.55 -34.56 95.48 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.742 2.295 . . . . 0.0 112.965 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.8 t -62.11 -44.6 99.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -41.06 97.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.11 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.89 -44.28 94.32 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.5 tptp -58.9 -51.24 70.89 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.384 1.074 . . . . 0.0 108.596 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -35.93 75.4 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 124.679 1.192 . . . . 0.0 111.605 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.7 mt -73.39 -27.17 61.32 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 119.057 0.844 . . . . 0.0 109.909 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -38.97 18.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.033 -1.042 . . . . 0.0 109.908 178.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.71 -47.57 85.69 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.554 1.542 . . . . 0.0 108.491 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -54.98 -41.19 70.87 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 122.79 0.436 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -71.32 -43.0 67.88 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.622 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.79 -41.96 96.61 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 118.164 0.438 . . . . 0.0 110.023 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tt -64.96 -45.45 85.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.591 1.156 . . . . 0.0 110.062 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.9 tp -60.51 -45.43 93.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.09 -39.66 93.22 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.404 0.681 . . . . 0.0 110.452 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.51 -48.01 81.43 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 118.861 0.755 . . . . 0.0 109.173 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.7 mt -60.68 -45.04 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -57.87 -50.96 71.54 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.778 0.831 . . . . 0.0 109.539 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.15 -42.06 85.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.747 1.219 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.55 -47.06 83.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.073 0.549 . . . . 0.0 109.693 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.92 -32.78 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.8 tp -63.5 -16.49 60.86 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -80.86 -28.12 47.6 Favored Glycine 0 C--N 1.342 0.895 0 N-CA-C 109.938 -1.265 . . . . 0.0 109.938 178.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.11 -48.44 35.63 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.4 mt -58.86 -38.46 78.83 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 123.814 0.846 . . . . 0.0 109.83 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.5 tp -62.75 -21.98 66.22 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.593 1.557 . . . . 0.0 111.107 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mp -103.32 -7.3 21.19 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.061 1.745 . . . . 0.0 111.052 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.61 32.74 7.91 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-O 118.159 -1.356 . . . . 0.0 114.122 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.4 tt . . . . . 0 C--O 1.247 0.943 0 CA-C-N 119.19 1.495 . . . . 0.0 108.786 179.556 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.8 tt . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -69.16 168.5 20.58 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 121.278 1.319 . . . . 0.0 109.612 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.8 t -159.0 170.14 22.75 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.5 138.7 59.86 Favored Pre-proline 0 CA--C 1.539 0.555 0 C-N-CA 123.98 0.912 . . . . 0.0 109.724 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.88 -29.28 85.77 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.517 2.145 . . . . 0.0 113.512 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.8 m -63.15 -35.43 71.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 119.153 0.888 . . . . 0.0 110.96 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 -70.44 -46.78 63.22 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.52 -44.07 80.43 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.7 tptt -59.42 -51.8 68.33 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.799 0.84 . . . . 0.0 108.799 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -60.21 -34.75 74.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.137 0.881 . . . . 0.0 111.87 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mp -70.6 -28.27 64.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 119.529 1.058 . . . . 0.0 109.666 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -40.06 16.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.138 -0.976 . . . . 0.0 109.983 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.1 tp -60.8 -43.67 97.86 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.92 1.288 . . . . 0.0 108.837 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.69 -41.06 80.86 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.887 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.0 mt -69.62 -43.79 71.98 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.161 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.13 -43.5 95.64 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 118.076 0.398 . . . . 0.0 109.947 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 tp -65.2 -44.34 88.68 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.889 0.875 . . . . 0.0 110.3 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.2 tp -59.77 -45.17 93.07 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 tt -62.01 -42.21 98.91 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.374 0.67 . . . . 0.0 109.981 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 tp -62.3 -46.65 87.78 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.486 0.584 . . . . 0.0 109.893 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.9 mt -63.9 -41.57 92.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.06 -49.52 77.57 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.931 0.787 . . . . 0.0 109.086 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.88 -42.39 84.5 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.894 1.278 . . . . 0.0 109.814 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -59.48 -55.44 34.59 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.741 1.216 . . . . 0.0 108.774 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 47.1 mm -63.0 -23.96 34.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 123.645 0.778 . . . . 0.0 110.967 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.74 -17.95 63.55 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.372 0.987 . . . . 0.0 109.336 178.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.69 -37.56 76.82 Favored Glycine 0 C--N 1.341 0.85 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.06 -33.4 73.25 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 117.755 0.777 . . . . 0.0 109.704 179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.38 -15.36 57.26 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.074 0.95 . . . . 0.0 111.547 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 68.9 mt -102.26 -6.44 23.13 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.856 1.262 . . . . 0.0 112.172 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 tt -121.38 -29.5 4.44 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.328 0.967 . . . . 0.0 112.763 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.4 -4.07 43.72 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.489 1.519 . . . . 0.0 112.332 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.3 tp . . . . . 0 C--O 1.246 0.901 0 C-N-CA 127.719 2.408 . . . . 0.0 106.138 179.514 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 44.0 mm . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -55.12 104.78 0.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 123.524 2.816 . . . . 0.0 110.272 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.0 t -167.79 -63.57 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 105.504 -2.036 . . . . 0.0 105.504 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.21 140.28 78.69 Favored Pre-proline 0 C--O 1.239 0.525 0 CA-C-O 117.732 -1.128 . . . . 0.0 108.8 -179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -54.33 -26.72 44.92 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.471 2.781 . . . . 0.0 114.99 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 37.3 t -61.66 -34.33 61.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 119.416 1.007 . . . . 0.0 109.289 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -66.85 -46.5 74.85 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.07 -42.19 89.8 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -61.52 -47.52 85.22 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.28 68.65 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 119.616 1.098 . . . . 0.0 112.244 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 tt -70.89 -51.29 27.13 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -34.68 76.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.557 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.2 tp -66.35 -44.9 81.94 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 124.238 1.015 . . . . 0.0 108.886 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.57 -45.91 90.46 Favored 'General case' 0 C--O 1.227 -0.123 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.94 -43.79 98.12 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.52 -38.07 88.52 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 119.043 -0.504 . . . . 0.0 110.325 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -64.32 -47.84 77.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.1 mt -58.11 -44.67 87.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.2 tp -62.26 -39.52 93.14 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.105 0.562 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.2 -46.45 83.85 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.801 0.728 . . . . 0.0 109.62 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.2 mm -63.93 -40.48 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.8 tp -59.71 -49.69 76.75 Favored 'General case' 0 C--O 1.226 -0.132 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 tt -58.64 -39.52 80.77 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.925 1.29 . . . . 0.0 110.402 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.1 tt -59.5 -54.11 50.36 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.341 1.056 . . . . 0.0 108.459 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.8 mm -65.11 -32.29 57.61 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 CA-C-O 119.512 -0.28 . . . . 0.0 110.55 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 41.8 tp -65.89 -15.38 62.9 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.89 0.768 . . . . 0.0 108.963 177.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.72 -47.02 5.52 Favored Glycine 0 C--N 1.34 0.788 0 N-CA-C 107.391 -2.283 . . . . 0.0 107.391 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.45 -40.33 74.64 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.3 mp -58.86 -17.98 28.71 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.713 1.205 . . . . 0.0 113.201 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.5 mt -76.79 -23.65 52.85 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.596 1.089 . . . . 0.0 111.131 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -121.34 -15.35 8.12 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.21 1.004 . . . . 0.0 113.514 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.04 14.74 60.19 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.277 -1.291 . . . . 0.0 113.632 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.9 tp . . . . . 0 C--O 1.246 0.91 0 C-N-CA 125.704 1.602 . . . . 0.0 107.243 179.934 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 17.5 tt . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -74.54 62.85 5.51 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.697 2.932 . . . . 0.0 112.123 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.6 m -103.0 -14.7 16.36 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.86 150.46 77.1 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-N 119.487 1.039 . . . . 0.0 108.637 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -52.84 -30.67 48.43 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.571 2.847 . . . . 0.0 115.719 -178.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.42 -31.25 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 118.981 0.81 . . . . 0.0 110.621 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -69.82 -48.89 57.35 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.3 mp -55.1 -44.71 75.16 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.95 -53.74 53.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.8 mtt-85 -59.66 -33.75 71.94 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.293 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.36 -25.23 61.44 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 120.074 1.306 . . . . 0.0 109.708 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -40.33 17.77 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.019 -1.051 . . . . 0.0 108.875 177.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.4 tp -65.92 -52.28 51.31 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.799 0.84 . . . . 0.0 109.875 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.74 -44.33 90.46 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 123.175 0.59 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.32 -33.17 71.19 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.573 -0.851 . . . . 0.0 111.346 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.6 tp -67.51 -42.86 82.16 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.78 -45.75 91.2 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.036 0.934 . . . . 0.0 109.099 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.1 tp -60.14 -43.66 95.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.21 -38.63 89.88 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.129 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.37 -43.99 92.79 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.102 0.864 . . . . 0.0 109.146 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.68 -45.52 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.14 -46.89 82.32 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.651 0.78 . . . . 0.0 110.349 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -56.36 -43.94 79.63 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.903 1.281 . . . . 0.0 110.158 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.96 -47.27 72.15 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.6 mm -61.23 -23.08 29.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 125.0 1.32 . . . . 0.0 110.873 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.64 -23.7 52.63 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.07 0.85 . . . . 0.0 109.021 178.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.82 -51.02 31.8 Favored Glycine 0 C--N 1.343 0.919 0 N-CA-C 108.549 -1.82 . . . . 0.0 108.549 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.53 97.13 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.311 0.645 . . . . 0.0 109.407 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.3 mt -60.38 -23.99 64.75 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 117.992 -1.004 . . . . 0.0 112.798 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 pp -102.41 -6.99 22.36 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.593 1.088 . . . . 0.0 111.924 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.7 tp -101.73 -29.43 11.9 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.167 1.387 . . . . 0.0 111.327 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.16 -1.62 59.22 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.189 1.376 . . . . 0.0 112.86 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 C--O 1.252 1.206 0 C-N-CA 127.226 2.21 . . . . 0.0 106.005 179.498 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 32.1 mm . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 106.086 -1.82 . . . . 0.0 106.086 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.57 175.88 8.89 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.493 2.129 . . . . 0.0 110.024 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.3 t -157.23 173.07 17.51 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.39 152.72 63.29 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-O 118.281 -0.866 . . . . 0.0 108.98 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.01 -43.43 42.9 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 121.716 1.611 . . . . 0.0 110.167 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.0 m -65.04 -32.84 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 O-C-N 121.808 -0.557 . . . . 0.0 109.772 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -70.42 -41.81 72.42 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.304 0.956 . . . . 0.0 108.986 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.6 mt -60.16 -41.15 92.19 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -61.68 -51.75 67.13 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.974 0.909 . . . . 0.0 108.554 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 -58.85 -36.79 75.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.498 1.519 . . . . 0.0 111.682 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.12 -39.4 72.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -42.5 90.22 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.31 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 tt -62.17 -55.38 29.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 124.025 0.93 . . . . 0.0 108.75 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -55.8 -44.95 78.28 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 123.918 0.887 . . . . 0.0 111.353 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.9 mt -68.45 -37.85 80.58 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.512 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.4 mt -66.78 -42.19 86.43 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.5 tp -63.72 -44.04 94.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.217 0.607 . . . . 0.0 109.705 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.04 -46.43 88.25 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 tp -62.03 -40.93 97.38 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 119.057 -0.497 . . . . 0.0 110.378 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 tt -62.31 -49.26 76.35 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 30.0 mm -60.49 -43.96 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 tt -58.69 -50.62 73.22 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.592 0.757 . . . . 0.0 109.345 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.35 -42.36 86.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 124.529 1.132 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.2 -46.89 81.93 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.315 0.646 . . . . 0.0 109.717 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.9 mt -64.98 -32.7 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.06 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.977 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 48.4 tp -63.18 -16.93 61.68 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.193 0.906 . . . . 0.0 109.262 177.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.27 -27.31 49.2 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.497 1.046 . . . . 0.0 110.696 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.19 -46.73 10.8 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 178.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 tp -54.64 -41.14 69.71 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 125.51 1.524 . . . . 0.0 112.067 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 pp -66.5 -8.03 23.74 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.01 -1.85 12.96 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.38 2.272 . . . . 0.0 110.073 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 79.79 34.37 31.19 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.138 -0.812 . . . . 0.0 111.745 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.2 mt . . . . . 0 C--O 1.248 1.019 0 C-N-CA 126.506 1.922 . . . . 0.0 109.175 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 23.3 pt . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 117.778 -1.106 . . . . 0.0 108.389 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.96 7.05 3.41 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.062 3.175 . . . . 0.0 114.369 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -60.91 -0.43 0.3 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.994 2.118 . . . . 0.0 116.596 -178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.11 145.91 88.98 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-N 120.85 1.659 . . . . 0.0 108.014 179.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -56.76 -47.2 24.62 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 121.967 1.778 . . . . 0.0 111.251 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.5 -32.88 60.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.631 -0.668 . . . . 0.0 111.018 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -71.97 -41.0 68.23 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.833 1.197 . . . . 0.0 108.831 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 75.4 mt -61.21 -41.47 96.9 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 177.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.9 tptp -62.27 -49.12 76.95 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.604 1.161 . . . . 0.0 109.434 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -60.14 -35.76 76.01 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.436 1.095 . . . . 0.0 110.84 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.5 mt -70.44 -45.7 65.3 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.23 -35.6 81.34 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.781 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -66.4 -45.78 78.83 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.29 -46.63 88.03 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.655 0.782 . . . . 0.0 109.263 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.33 -40.7 97.22 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.062 -0.494 . . . . 0.0 110.353 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.3 tt -63.4 -45.53 90.59 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.8 -43.44 98.79 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.019 0.528 . . . . 0.0 109.957 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.6 tp -60.27 -44.37 95.39 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.7 tt -62.2 -41.37 98.3 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 123.316 0.647 . . . . 0.0 109.796 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.0 tt -63.11 -43.84 97.32 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.65 0.659 . . . . 0.0 109.775 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.7 mt -63.75 -44.8 98.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.15 -48.97 79.65 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.655 0.782 . . . . 0.0 109.245 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.1 tt -55.65 -43.99 76.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.193 1.397 . . . . 0.0 111.089 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 19.2 mt -64.94 -45.12 87.09 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 123.694 0.798 . . . . 0.0 109.358 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.0 mt -65.5 -33.04 60.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.136 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 43.3 tp -66.09 -14.98 62.67 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 118.854 0.752 . . . . 0.0 108.98 177.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.2 -51.71 3.46 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 106.792 -2.523 . . . . 0.0 106.792 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.57 -38.08 68.89 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.201 1.0 . . . . 0.0 110.042 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.6 tt -58.12 -24.23 57.97 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 125.505 1.522 . . . . 0.0 112.064 179.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.7 mt -102.1 -4.9 25.16 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.442 1.497 . . . . 0.0 112.205 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.4 tp -112.58 -29.18 7.55 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.908 1.283 . . . . 0.0 112.297 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.95 5.51 68.07 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.587 1.089 . . . . 0.0 111.825 -178.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--O 1.247 0.951 0 C-N-CA 128.147 2.579 . . . . 0.0 104.641 179.715 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 44.9 pt . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 117.216 -1.373 . . . . 0.0 108.014 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -69.74 162.77 40.76 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 121.479 1.453 . . . . 0.0 109.585 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t -167.28 173.09 9.23 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 179.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.8 m -55.5 143.89 55.76 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 123.716 0.807 . . . . 0.0 110.067 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -59.85 -34.21 95.66 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 121.901 1.734 . . . . 0.0 111.136 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -63.4 -27.74 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.51 0.724 . . . . 0.0 110.842 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -69.81 -51.16 36.03 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.92 -41.97 79.13 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -62.86 -47.72 82.14 Favored 'General case' 0 C--N 1.341 0.239 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.78 -40.86 85.21 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.127 0.876 . . . . 0.0 111.701 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.75 -25.83 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 118.879 0.763 . . . . 0.0 110.471 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.8 -40.75 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.348 -0.834 . . . . 0.0 109.932 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.3 tp -64.1 -47.77 78.74 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.909 0.884 . . . . 0.0 109.197 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.6 -43.83 89.69 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.52 -43.45 97.11 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-O 119.093 -0.48 . . . . 0.0 110.348 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.53 -48.51 81.45 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 122.909 0.484 . . . . 0.0 109.727 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.91 -45.01 94.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 119.257 -0.402 . . . . 0.0 110.833 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.14 -46.93 84.79 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.91 -41.33 97.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.564 0.746 . . . . 0.0 110.507 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.1 -50.38 72.14 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.944 0.793 . . . . 0.0 109.948 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 mm -62.65 -43.76 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.48 -49.61 76.72 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 123.269 0.627 . . . . 0.0 109.968 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.3 tp -56.65 -43.12 80.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.335 1.454 . . . . 0.0 111.437 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.8 mt -63.63 -47.59 80.74 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.74 0.816 . . . . 0.0 109.079 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 42.6 mm -65.44 -28.93 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.74 -16.28 63.63 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.066 0.848 . . . . 0.0 109.044 177.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.68 -52.83 3.22 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 106.932 -2.467 . . . . 0.0 106.932 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.71 -37.67 68.71 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.656 0.783 . . . . 0.0 110.397 179.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.3 tt -58.56 -23.74 59.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.291 1.437 . . . . 0.0 112.013 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.1 mt -102.25 -7.64 21.96 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.212 1.405 . . . . 0.0 112.415 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.4 mp -111.13 -27.98 8.49 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.758 1.223 . . . . 0.0 112.431 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.85 -5.08 79.22 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 125.282 1.42 . . . . 0.0 111.726 -178.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 C--O 1.246 0.884 0 C-N-CA 129.132 2.973 . . . . 0.0 104.344 179.361 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 46.6 pt . . . . . 0 N--CA 1.476 0.862 0 CA-C-O 117.24 -1.362 . . . . 0.0 108.08 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -69.98 170.59 16.47 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 121.525 1.483 . . . . 0.0 109.022 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.7 p -154.07 166.49 32.87 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.63 136.07 82.51 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 123.691 0.796 . . . . 0.0 110.175 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -60.13 -25.22 79.33 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.369 2.046 . . . . 0.0 112.936 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -63.49 -31.14 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.36 -0.838 . . . . 0.0 110.538 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -69.22 -46.66 66.85 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.67 -41.91 91.68 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -61.93 -48.5 80.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 118.197 -0.906 . . . . 0.0 108.94 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtt180 -60.15 -30.45 69.32 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.664 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.77 -50.83 39.45 Favored 'General case' 0 C--O 1.226 -0.183 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -36.36 82.34 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.41 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.25 -44.55 83.4 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -58.95 -45.28 90.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -63.05 -41.89 99.59 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.35 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 tt -61.94 -47.27 85.64 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.016 0.526 . . . . 0.0 109.656 179.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 80.5 mt -63.13 -42.11 99.43 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.342 0.657 . . . . 0.0 110.358 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.4 tp -60.62 -47.06 87.92 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -61.26 -40.72 95.13 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 123.475 0.71 . . . . 0.0 110.178 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.1 tt -61.56 -49.19 77.65 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.61 -42.1 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.84 -49.73 76.65 Favored 'General case' 0 C--O 1.226 -0.175 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.8 tp -60.69 -36.38 78.63 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.445 1.098 . . . . 0.0 110.504 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.53 -54.87 37.52 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 179.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.0 mm -65.93 -30.17 49.17 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.155 0 CA-C-O 119.191 -0.433 . . . . 0.0 110.668 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.09 -20.81 64.42 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.443 1.02 . . . . 0.0 108.754 177.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.71 -44.87 5.65 Favored Glycine 0 C--N 1.34 0.802 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.85 -41.37 86.83 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.037 0.935 . . . . 0.0 110.042 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.6 mt -60.54 -22.62 63.83 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 124.612 1.165 . . . . 0.0 112.157 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.9 mt -67.21 -23.06 65.69 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.44 1.018 . . . . 0.0 109.665 178.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.7 mp -106.91 -3.19 20.48 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.39 1.876 . . . . 0.0 109.987 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.06 24.93 39.07 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 118.612 -1.104 . . . . 0.0 113.087 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp . . . . . 0 C--O 1.25 1.12 0 C-N-CA 125.502 1.521 . . . . 0.0 109.254 179.61 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 32.5 mm . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -72.85 75.55 2.65 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 123.225 2.617 . . . . 0.0 110.305 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 p -149.64 -56.7 0.19 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.716 0.807 . . . . 0.0 109.929 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.98 133.91 87.29 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -55.59 -29.82 71.83 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.727 2.285 . . . . 0.0 114.0 -178.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.76 -35.39 67.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-N 119.145 0.884 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -67.36 -47.3 70.83 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 179.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -57.15 -43.73 82.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.2 -50.51 73.39 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 123.78 0.832 . . . . 0.0 108.865 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -40.35 78.02 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.823 1.249 . . . . 0.0 112.036 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.96 -26.8 61.49 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 124.235 1.014 . . . . 0.0 110.412 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.38 -38.39 20.34 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.247 -0.908 . . . . 0.0 109.453 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.5 tp -64.04 -45.79 87.27 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 124.223 1.009 . . . . 0.0 108.386 178.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.64 -44.76 93.39 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.5 tp -63.36 -43.72 96.85 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.506 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.32 -48.44 81.73 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.02 0.528 . . . . 0.0 109.703 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.2 tp -62.92 -43.16 99.55 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.759 0.424 . . . . 0.0 110.924 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -59.86 -47.24 86.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.3 tp -62.37 -39.71 94.07 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.203 0.601 . . . . 0.0 110.605 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.59 -48.49 79.21 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.574 0.625 . . . . 0.0 109.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.8 -41.04 91.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.8 tp -58.81 -50.39 74.14 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.05 -40.59 85.56 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 0.0 110.236 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -58.83 -56.3 24.02 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.538 1.135 . . . . 0.0 108.955 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.2 mm -64.26 -31.87 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.091 0 CA-C-O 119.098 -0.477 . . . . 0.0 110.685 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 40.3 tp -62.99 -15.66 57.05 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.213 0.915 . . . . 0.0 109.911 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.11 -37.43 18.54 Favored Glycine 0 C--N 1.339 0.745 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 178.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.81 -38.19 88.29 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -57.55 -21.25 37.28 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.766 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 84.5 mt -66.24 -28.82 69.02 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.977 1.262 . . . . 0.0 109.937 178.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tt -85.01 -13.34 50.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.57 1.548 . . . . 0.0 109.204 178.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 122.19 -22.92 7.41 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 127.345 2.403 . . . . 0.0 112.47 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.246 0.907 0 CA-C-N 119.597 1.699 . . . . 0.0 107.299 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.51 156.74 54.84 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 121.741 1.627 . . . . 0.0 108.821 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.7 p -131.23 -83.9 0.52 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.536 0.335 . . . . 0.0 111.875 -178.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -53.84 149.88 15.74 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 125.0 1.32 . . . . 0.0 111.247 -178.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -56.21 -27.41 65.92 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.177 2.585 . . . . 0.0 113.859 -178.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.72 -29.8 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 121.4 -0.813 . . . . 0.0 110.114 178.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -69.85 -42.1 74.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.745 1.157 . . . . 0.0 108.311 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.92 -41.33 99.44 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -63.81 -47.54 80.42 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 124.649 1.18 . . . . 0.0 108.51 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -57.55 -35.27 70.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.628 1.971 . . . . 0.0 111.38 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -72.29 -48.86 39.12 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -36.94 81.76 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.924 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -64.97 -44.42 89.42 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 124.166 0.986 . . . . 0.0 108.427 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.86 -44.97 93.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.59 -49.35 75.58 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.889 0.476 . . . . 0.0 110.363 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.9 -38.41 88.26 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.545 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.8 tp -65.14 -43.74 90.91 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.744 0.702 . . . . 0.0 109.703 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -60.72 -45.87 92.58 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.1 tp -61.85 -40.5 95.57 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.034 0.534 . . . . 0.0 110.321 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.66 -47.22 84.63 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 77.8 mt -61.9 -41.98 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.44 -49.67 76.91 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 118.819 0.736 . . . . 0.0 109.337 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.75 -42.37 88.69 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.53 1.132 . . . . 0.0 110.118 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -58.87 -51.56 69.51 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 125.11 1.364 . . . . 0.0 108.637 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.9 -33.01 58.03 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.049 0 C-N-CA 123.175 0.59 . . . . 0.0 110.179 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.32 -16.46 62.24 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.189 0.904 . . . . 0.0 109.59 177.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.59 -37.89 8.5 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 178.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.2 -50.89 51.26 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 73.6 mt -56.01 -22.04 24.77 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 125.345 1.458 . . . . 0.0 112.307 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.92 -34.37 75.95 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.389 1.076 . . . . 0.0 108.782 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -85.83 -11.47 53.31 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.239 1.416 . . . . 0.0 110.446 178.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 121.15 -15.34 9.41 Favored Glycine 0 CA--C 1.529 0.969 0 C-N-CA 126.093 1.806 . . . . 0.0 114.624 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 53.2 tp . . . . . 0 C--O 1.247 0.947 0 CA-C-N 119.83 1.815 . . . . 0.0 107.463 179.637 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 45.5 pt . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 116.956 -1.497 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -69.02 170.34 15.91 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 121.347 1.364 . . . . 0.0 109.055 178.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 28.5 m -156.31 165.43 36.38 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.36 141.47 42.45 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.186 0.994 . . . . 0.0 109.472 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -56.3 -31.24 83.89 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.692 2.261 . . . . 0.0 114.133 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.9 m -63.05 -36.67 76.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 119.363 0.983 . . . . 0.0 111.193 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -71.21 -44.62 65.03 Favored 'General case' 0 C--N 1.339 0.119 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.0 mt -57.75 -43.86 85.71 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.06 -51.5 69.37 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.083 0.953 . . . . 0.0 108.528 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.8 mtp180 -59.97 -34.51 73.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.168 0.894 . . . . 0.0 112.168 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 mt -72.06 -29.23 63.94 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.619 1.099 . . . . 0.0 109.65 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -36.07 21.38 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.008 -1.058 . . . . 0.0 110.255 178.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -64.84 -44.99 88.0 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.651 1.181 . . . . 0.0 108.787 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.34 -41.96 85.76 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 122.827 0.451 . . . . 0.0 109.971 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.19 -46.38 80.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.78 -44.75 96.38 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.76 -43.17 99.38 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.741 0.817 . . . . 0.0 110.321 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.5 tp -59.32 -46.5 88.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.01 -41.41 98.05 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.932 0.493 . . . . 0.0 110.146 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.92 -49.37 76.43 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 123.564 0.746 . . . . 0.0 109.409 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.5 mm -61.87 -40.36 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.91 -47.54 85.91 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.037 0.835 . . . . 0.0 109.246 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.86 -37.38 81.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.424 1.09 . . . . 0.0 110.081 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.11 -50.84 68.9 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.553 1.141 . . . . 0.0 108.12 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.5 mt -62.55 -29.5 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 123.696 0.798 . . . . 0.0 109.821 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.77 -17.23 55.19 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 118.831 0.741 . . . . 0.0 109.935 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.26 -35.52 10.78 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 109.938 -1.265 . . . . 0.0 109.938 178.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.87 91.41 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.3 mt -55.17 -23.59 22.43 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.419 1.088 . . . . 0.0 112.36 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.66 -26.5 67.82 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.494 1.043 . . . . 0.0 110.116 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.8 mt -86.52 -12.45 48.78 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.945 1.698 . . . . 0.0 110.068 178.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 121.32 -21.98 8.02 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 126.441 1.972 . . . . 0.0 113.239 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.3 tt . . . . . 0 C--O 1.247 0.953 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 179.315 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 46.2 pt . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 117.335 -1.316 . . . . 0.0 108.227 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -71.57 176.61 7.86 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.189 1.926 . . . . 0.0 108.758 178.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 52.31 67.71 0.93 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.751 1.22 . . . . 0.0 110.992 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.5 m -55.21 147.9 33.48 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 123.467 0.707 . . . . 0.0 110.151 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -56.17 -30.74 80.88 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.756 2.304 . . . . 0.0 113.488 -178.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.6 m -63.66 -33.28 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.45 -0.781 . . . . 0.0 109.943 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -72.47 -40.67 66.77 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 119.417 1.008 . . . . 0.0 108.581 178.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.83 -44.59 90.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -61.37 -47.3 86.47 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 124.224 1.01 . . . . 0.0 109.602 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.3 mtp85 -57.89 -34.83 70.22 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 119.68 1.127 . . . . 0.0 111.76 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 mp -71.26 -46.75 60.26 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 119.991 1.269 . . . . 0.0 107.666 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -34.23 77.63 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.986 -0.53 . . . . 0.0 111.253 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.0 tp -67.75 -44.47 77.46 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.053 0.941 . . . . 0.0 108.818 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.92 -45.66 91.88 Favored 'General case' 0 C--O 1.226 -0.151 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.21 -48.11 83.03 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.124 0.57 . . . . 0.0 109.825 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.55 -44.64 93.19 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.36 0.664 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.9 tt -60.6 -43.43 97.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.107 0.963 . . . . 0.0 110.549 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -58.8 -51.46 69.89 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.4 tt -59.96 -40.05 87.69 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.792 0.837 . . . . 0.0 110.633 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -63.6 -43.91 95.52 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.381 0.672 . . . . 0.0 110.117 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.51 -42.87 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.25 -48.8 80.27 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.28 -37.69 78.29 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.084 1.354 . . . . 0.0 110.664 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 tt -59.74 -52.04 67.18 Favored 'General case' 0 C--O 1.23 0.061 0 C-N-CA 124.727 1.211 . . . . 0.0 108.546 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 48.3 mm -65.19 -38.4 82.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 43.6 tp -65.08 -13.9 59.15 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.15 -44.49 5.94 Favored Glycine 0 C--N 1.341 0.814 0 N-CA-C 107.948 -2.061 . . . . 0.0 107.948 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.82 -36.48 76.88 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -26.69 63.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.508 1.523 . . . . 0.0 111.192 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 73.6 mt -69.09 -19.98 64.07 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.412 -0.805 . . . . 0.0 111.192 179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -104.58 -28.28 11.36 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.734 1.213 . . . . 0.0 109.757 179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.41 -22.82 33.36 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 126.845 2.164 . . . . 0.0 112.094 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.022 0 C-N-CA 128.154 2.582 . . . . 0.0 109.922 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.422 HD12 ' H1 ' ' A' ' 1' ' ' ILE . 2.4 mp . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -74.05 72.3 4.05 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.518 2.812 . . . . 0.0 110.609 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.6 t -71.52 73.83 0.76 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.324 1.45 . . . . 0.0 108.698 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.3 m -63.08 153.17 82.11 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 124.751 1.22 . . . . 0.0 109.257 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.25 -25.9 58.49 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.05 2.5 . . . . 0.0 114.603 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -60.58 -30.53 46.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 119.311 0.96 . . . . 0.0 111.001 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -66.68 -50.11 63.93 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 79.0 mt -59.16 -41.84 89.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -60.86 -48.5 81.54 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.293 1.037 . . . . 0.0 109.9 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -62.2 -35.94 80.41 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 119.438 1.017 . . . . 0.0 110.962 179.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 69.1 mt -70.46 -44.81 67.01 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.427 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -64.23 -39.55 94.2 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.646 -0.692 . . . . 0.0 110.182 178.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.1 tp -63.1 -48.96 76.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.705 0.802 . . . . 0.0 109.258 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -57.91 -45.23 86.8 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.321 0.648 . . . . 0.0 109.908 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.7 mt -64.58 -42.58 95.53 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.77 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.02 -39.13 92.95 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.502 0.592 . . . . 0.0 109.905 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.2 tp -65.05 -44.12 90.05 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.1 tp -59.58 -45.58 91.45 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.3 -43.39 98.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.452 0.701 . . . . 0.0 109.813 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.47 -49.33 77.97 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-N 118.652 0.66 . . . . 0.0 109.571 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.0 mm -62.74 -39.43 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.0 tp -61.48 -47.91 83.5 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.161 0.891 . . . . 0.0 109.101 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.48 -40.08 85.83 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.977 1.311 . . . . 0.0 109.443 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -61.63 -51.19 69.49 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -62.12 -23.73 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 124.633 1.173 . . . . 0.0 110.912 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.75 -19.51 62.54 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.664 1.12 . . . . 0.0 109.485 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.07 -44.33 77.76 Favored Glycine 0 C--N 1.343 0.963 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.99 -42.54 80.61 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.9 tt -55.14 -43.14 73.91 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.898 0.879 . . . . 0.0 111.304 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 pp -79.89 -9.12 59.64 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.7 tt -99.59 -29.62 12.59 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.213 1.005 . . . . 0.0 110.77 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 100.26 0.56 55.83 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.453 1.501 . . . . 0.0 113.024 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 62.2 tp . . . . . 0 C--O 1.247 0.942 0 C-N-CA 126.322 1.849 . . . . 0.0 106.765 179.58 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 28.5 mm . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -64.94 169.92 11.09 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 121.834 1.689 . . . . 0.0 109.512 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.3 t -154.76 -147.98 0.23 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.7 p -47.28 154.37 0.82 Allowed Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 127.795 2.438 . . . . 0.0 112.991 -178.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.07 -29.71 87.91 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.952 2.434 . . . . 0.0 113.657 -178.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.4 t -68.65 -39.02 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.9 m80 -67.78 -38.31 83.2 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 119.092 0.86 . . . . 0.0 109.364 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.5 mt -58.48 -45.27 89.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -52.74 64.46 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.327 1.051 . . . . 0.0 108.851 177.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -55.27 -34.4 64.03 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.785 1.234 . . . . 0.0 112.577 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mp -73.27 -27.52 61.61 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 119.376 0.989 . . . . 0.0 109.86 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.45 -39.5 18.88 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 120.944 -1.097 . . . . 0.0 109.485 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.2 tp -60.74 -41.28 95.06 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 124.947 1.299 . . . . 0.0 108.614 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.82 -41.73 82.82 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.7 mt -71.7 -39.61 70.08 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.13 -37.44 80.06 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 tt -62.93 -48.85 77.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.233 1.013 . . . . 0.0 108.657 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.02 -43.45 86.75 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.4 tp -63.44 -38.24 90.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.066 0.546 . . . . 0.0 110.417 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.8 tp -63.88 -45.15 90.71 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 118.771 0.714 . . . . 0.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.1 mm -63.99 -40.98 91.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.32 -49.1 79.11 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.73 -41.43 86.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.787 1.235 . . . . 0.0 110.265 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.48 -52.09 67.1 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.688 1.195 . . . . 0.0 108.606 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.2 mt -63.24 -31.37 52.5 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.065 0 C-N-CA 123.303 0.641 . . . . 0.0 110.134 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.79 -16.74 59.35 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.016 0.826 . . . . 0.0 109.423 178.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.89 -51.44 5.1 Favored Glycine 0 C--N 1.34 0.775 0 N-CA-C 107.858 -2.097 . . . . 0.0 107.858 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.91 -34.32 77.19 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.153 0.581 . . . . 0.0 109.89 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.0 tt -55.35 -37.96 68.15 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.722 1.209 . . . . 0.0 111.017 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 83.3 mt -69.62 -12.26 61.5 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.226 0.61 . . . . 0.0 112.167 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.4 tp -108.04 -2.27 19.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.653 1.981 . . . . 0.0 110.556 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 122.42 -9.46 9.4 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 116.288 -2.396 . . . . 0.0 115.679 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.9 mp . . . . . 0 N--CA 1.481 1.082 1 C-N-CA 133.404 4.681 . . . . 0.0 109.414 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 35.7 mm . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -67.7 172.34 10.69 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 122.33 2.02 . . . . 0.0 109.901 179.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.9 t 52.56 23.93 2.83 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.46 1.104 . . . . 0.0 113.815 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.465 ' HG ' ' CE1' ' A' ' 7' ' ' HIS . 59.7 p -58.43 154.78 31.42 Favored Pre-proline 0 C--O 1.24 0.59 0 CA-C-N 118.853 0.751 . . . . 0.0 110.687 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -60.45 -25.21 79.99 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.828 1.686 . . . . 0.0 111.838 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.8 t -65.18 -43.74 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.465 ' CE1' ' HG ' ' A' ' 4' ' ' SER . 9.6 m-70 -65.34 -44.38 87.93 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.15 -44.22 87.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -59.66 -49.15 78.87 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 178.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.5 84.63 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.767 0.827 . . . . 0.0 112.223 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -74.56 -25.17 59.13 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.921 0.889 . . . . 0.0 110.965 -178.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -38.73 20.05 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 tp -62.88 -46.9 85.67 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.39 -42.76 87.82 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.241 0.616 . . . . 0.0 110.54 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 64.4 tp -64.85 -47.4 78.07 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.032 0.378 . . . . 0.0 110.49 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.21 -42.68 99.53 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.31 -42.98 99.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.285 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.6 tp -58.58 -47.37 84.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.5 tp -62.14 -42.16 98.97 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.642 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.15 -46.34 87.62 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.806 0.442 . . . . 0.0 110.284 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 22.3 mm -62.11 -43.1 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.85 -51.36 70.36 Favored 'General case' 0 N--CA 1.461 0.112 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.33 -43.37 83.3 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.355 1.062 . . . . 0.0 110.868 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.63 -46.05 87.46 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.082 0.553 . . . . 0.0 110.061 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.4 mt -64.44 -35.26 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.08 0 C-N-CA 123.182 0.593 . . . . 0.0 110.077 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.8 tt -61.94 -17.15 55.87 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.09 -34.6 36.99 Favored Glycine 0 C--N 1.341 0.832 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.71 -45.19 62.58 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.99 -30.41 69.11 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 122.883 0.473 . . . . 0.0 110.098 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.2 -19.82 64.85 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.301 1.041 . . . . 0.0 111.14 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.13 -2.1 21.29 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.72 2.008 . . . . 0.0 110.965 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.33 31.07 20.49 Favored Glycine 0 CA--C 1.529 0.96 0 CA-C-O 118.41 -1.217 . . . . 0.0 113.682 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 116.635 -1.65 . . . . 0.0 107.335 179.652 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.2 mp . . . . . 0 N--CA 1.477 0.878 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -67.23 171.58 11.3 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.234 1.956 . . . . 0.0 111.231 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.4 m -158.76 155.83 28.68 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.751 1.62 . . . . 0.0 106.894 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.446 ' HG ' ' CE1' ' A' ' 7' ' ' HIS . 54.3 p -65.26 154.6 86.96 Favored Pre-proline 0 C--O 1.242 0.662 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.35 -25.8 76.59 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 121.478 1.452 . . . . 0.0 110.569 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.7 t -64.59 -48.37 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 123.931 0.892 . . . . 0.0 108.837 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.446 ' CE1' ' HG ' ' A' ' 4' ' ' SER . 6.8 m-70 -65.75 -38.18 88.38 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.485 1.038 . . . . 0.0 109.147 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.39 -43.8 98.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -62.77 -47.59 82.84 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.55 1.14 . . . . 0.0 108.292 178.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.3 tpm_? -56.63 -39.32 73.46 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.865 1.666 . . . . 0.0 111.266 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.76 -46.37 58.64 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -38.55 86.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.269 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.5 tp -66.4 -43.65 85.23 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.666 1.186 . . . . 0.0 109.402 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.56 -46.52 89.87 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.9 mt -63.84 -40.12 95.82 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.529 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.0 -46.75 87.85 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.428 0.558 . . . . 0.0 109.856 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.32 -42.44 98.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.193 0.452 . . . . 0.0 110.338 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -60.16 -47.01 87.72 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 tt -60.82 -41.09 95.07 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 123.841 0.856 . . . . 0.0 110.41 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.16 -49.18 76.88 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 118.481 0.582 . . . . 0.0 109.868 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.0 mm -64.11 -38.48 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.98 -49.44 77.43 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.09 -39.79 83.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.902 1.281 . . . . 0.0 109.933 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -61.26 -53.46 56.52 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.9 mt -63.36 -30.41 49.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 123.817 0.847 . . . . 0.0 110.935 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 51.7 tp -62.44 -15.91 52.19 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.067 0.849 . . . . 0.0 109.557 178.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.2 -37.68 87.02 Favored Glycine 0 C--N 1.341 0.814 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -31.64 71.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.859 0.829 . . . . 0.0 110.146 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -11.81 43.52 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.156 -0.965 . . . . 0.0 111.564 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.7 mt -99.01 -9.26 24.18 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.546 1.138 . . . . 0.0 111.669 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -120.32 -28.14 5.09 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.617 1.167 . . . . 0.0 112.069 -179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.17 0.44 58.47 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 125.309 1.433 . . . . 0.0 111.354 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 pp . . . . . 0 C--O 1.253 1.26 0 C-N-CA 129.045 2.938 . . . . 0.0 106.329 179.563 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo . . . . . 0 N--CA 1.46 -0.442 0 CA-C-O 119.739 -0.192 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.53 -35.18 68.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.524 -0.735 . . . . 0.0 109.468 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -64.31 -50.04 69.42 Favored 'General case' 0 C--N 1.342 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.96 -40.08 87.81 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -59.06 -50.93 72.18 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -34.84 78.67 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.434 1.015 . . . . 0.0 111.156 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.3 tp -69.45 -31.16 69.3 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 119.244 0.929 . . . . 0.0 109.633 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -35.4 22.81 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.153 -0.967 . . . . 0.0 109.973 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.89 -46.77 83.42 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -58.08 -44.35 87.52 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.334 0.654 . . . . 0.0 109.916 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 tp -63.77 -44.32 93.75 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.4 -42.09 99.16 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.88 -44.5 95.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.337 0.655 . . . . 0.0 109.679 179.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.5 tt -57.82 -50.06 74.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.9 tp -60.61 -38.77 85.79 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.535 0.734 . . . . 0.0 111.078 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.58 -48.9 75.5 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.8 mt -61.37 -41.09 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.8 tt -59.35 -51.11 71.34 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.09 -39.93 83.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.809 1.244 . . . . 0.0 110.468 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -59.42 -52.09 67.08 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.413 1.085 . . . . 0.0 108.404 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 77.7 mt . . . . . 0 C--N 1.335 -0.064 0 C-N-CA 123.034 0.534 . . . . 0.0 109.912 179.783 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo . . . . . 0 N--CA 1.462 -0.375 0 N-CA-C 113.504 0.54 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -62.75 -33.19 58.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.416 -0.802 . . . . 0.0 109.742 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -71.56 -40.53 69.92 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -59.74 -44.0 93.97 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -62.13 -47.58 83.95 Favored 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.778 1.231 . . . . 0.0 108.978 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -58.84 -36.41 74.51 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.144 1.378 . . . . 0.0 111.372 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -73.4 -48.18 35.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.47 -36.13 79.56 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.663 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.67 -44.26 86.79 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.94 -45.22 93.31 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -58.9 -50.38 74.24 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.873 0.869 . . . . 0.0 109.674 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.1 -45.03 83.74 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.761 0.825 . . . . 0.0 110.023 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.1 mt -62.61 -43.26 99.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.5 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.42 -45.13 94.72 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 119.005 0.82 . . . . 0.0 108.983 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.6 -42.42 98.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.22 0.608 . . . . 0.0 110.059 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.55 -48.78 79.45 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 123.472 0.709 . . . . 0.0 109.422 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.73 -42.65 95.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 123.726 0.81 . . . . 0.0 109.191 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -59.41 -49.43 77.84 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 118.741 0.7 . . . . 0.0 109.529 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 61.8 tp -59.85 -39.75 86.25 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.322 1.049 . . . . 0.0 110.125 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.65 -52.13 66.43 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.651 1.18 . . . . 0.0 108.418 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.0 mt . . . . . 0 N--CA 1.46 0.071 0 C-N-CA 123.372 0.669 . . . . 0.0 109.865 179.691 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo . . . . . 0 N--CA 1.459 -0.502 0 CA-C-O 119.734 -0.194 . . . . 0.0 112.103 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.01 -31.98 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 O-C-N 121.429 -0.794 . . . . 0.0 110.44 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -71.16 -39.81 71.69 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.014 1.279 . . . . 0.0 107.862 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.79 -43.07 99.76 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -62.13 -46.79 87.43 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.86 1.264 . . . . 0.0 108.698 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -57.3 -36.78 71.49 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.006 1.722 . . . . 0.0 111.231 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.7 tp -72.64 -49.79 29.51 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -35.77 73.6 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 118.933 -0.556 . . . . 0.0 111.475 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.7 tp -67.77 -43.42 79.85 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.322 1.049 . . . . 0.0 109.255 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -61.67 -47.44 85.36 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.1 mt -63.29 -42.6 99.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.903 0.481 . . . . 0.0 110.229 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.63 -45.5 93.81 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.85 -42.56 99.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.696 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.5 -53.42 57.67 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.78 -44.18 94.03 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.774 0.83 . . . . 0.0 110.849 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.34 -49.64 76.8 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.204 0.602 . . . . 0.0 110.743 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.9 mm -64.47 -38.72 83.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.3 tp -60.69 -49.41 77.61 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.82 -41.96 92.43 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.997 1.319 . . . . 0.0 109.821 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 tt -59.29 -52.32 66.18 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 124.392 1.077 . . . . 0.0 108.622 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 89.5 mt . . . . . 0 CA--C 1.529 0.16 0 C-N-CA 123.601 0.76 . . . . 0.0 110.655 -179.842 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 N--CA 1.46 -0.499 0 CA-C-O 119.564 -0.265 . . . . 0.0 112.575 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.66 -29.68 47.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 121.363 -0.835 . . . . 0.0 110.791 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -69.8 -49.08 56.23 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.64 -42.76 84.07 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -60.82 -47.05 88.12 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.239 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 -58.57 -36.97 74.77 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 119.662 1.119 . . . . 0.0 111.657 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -71.61 -48.13 50.05 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.39 -33.22 75.06 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.642 -0.694 . . . . 0.0 111.913 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.0 tp -67.46 -48.81 66.12 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.28 -48.48 80.34 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.272 0.629 . . . . 0.0 109.308 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.4 tp -59.51 -46.69 88.12 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.568 0.747 . . . . 0.0 110.684 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.89 -44.89 95.88 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.11 0.414 . . . . 0.0 110.573 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.74 -43.72 95.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.208 0.458 . . . . 0.0 110.365 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.1 tp -59.88 -47.08 87.2 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.95 -41.13 95.71 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.644 0.778 . . . . 0.0 110.473 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.42 -50.67 70.57 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -61.67 -40.89 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.94 -52.2 66.77 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.02 -40.22 80.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.675 1.19 . . . . 0.0 110.556 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.44 -57.01 14.84 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.424 1.09 . . . . 0.0 108.879 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.8 mm . . . . . 0 CA--C 1.528 0.131 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.997 -179.748 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo . . . . . 0 N--CA 1.46 -0.486 0 CA-C-O 119.222 -0.407 . . . . 0.0 112.965 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.8 t -62.11 -44.6 99.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -41.06 97.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.11 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.89 -44.28 94.32 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.5 tptp -58.9 -51.24 70.89 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.384 1.074 . . . . 0.0 108.596 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -35.93 75.4 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 124.679 1.192 . . . . 0.0 111.605 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.7 mt -73.39 -27.17 61.32 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 119.057 0.844 . . . . 0.0 109.909 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -38.97 18.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.033 -1.042 . . . . 0.0 109.908 178.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.71 -47.57 85.69 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.554 1.542 . . . . 0.0 108.491 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -54.98 -41.19 70.87 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 122.79 0.436 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -71.32 -43.0 67.88 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.622 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.79 -41.96 96.61 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 118.164 0.438 . . . . 0.0 110.023 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tt -64.96 -45.45 85.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.591 1.156 . . . . 0.0 110.062 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.9 tp -60.51 -45.43 93.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.09 -39.66 93.22 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.404 0.681 . . . . 0.0 110.452 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.51 -48.01 81.43 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 118.861 0.755 . . . . 0.0 109.173 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.7 mt -60.68 -45.04 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -57.87 -50.96 71.54 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.778 0.831 . . . . 0.0 109.539 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.15 -42.06 85.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.747 1.219 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.55 -47.06 83.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.073 0.549 . . . . 0.0 109.693 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.5 mt . . . . . 0 N--CA 1.462 0.155 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.72 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 N--CA 1.46 -0.47 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.8 m -63.15 -35.43 71.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 119.153 0.888 . . . . 0.0 110.96 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 -70.44 -46.78 63.22 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.52 -44.07 80.43 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.7 tptt -59.42 -51.8 68.33 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.799 0.84 . . . . 0.0 108.799 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -60.21 -34.75 74.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.137 0.881 . . . . 0.0 111.87 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mp -70.6 -28.27 64.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 119.529 1.058 . . . . 0.0 109.666 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -40.06 16.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.138 -0.976 . . . . 0.0 109.983 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.1 tp -60.8 -43.67 97.86 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.92 1.288 . . . . 0.0 108.837 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.69 -41.06 80.86 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.887 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.0 mt -69.62 -43.79 71.98 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.161 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.13 -43.5 95.64 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 118.076 0.398 . . . . 0.0 109.947 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 tp -65.2 -44.34 88.68 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.889 0.875 . . . . 0.0 110.3 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.2 tp -59.77 -45.17 93.07 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 tt -62.01 -42.21 98.91 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.374 0.67 . . . . 0.0 109.981 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 tp -62.3 -46.65 87.78 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.486 0.584 . . . . 0.0 109.893 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.9 mt -63.9 -41.57 92.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.06 -49.52 77.57 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.931 0.787 . . . . 0.0 109.086 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.88 -42.39 84.5 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.894 1.278 . . . . 0.0 109.814 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -59.48 -55.44 34.59 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.741 1.216 . . . . 0.0 108.774 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 47.1 mm . . . . . 0 CA--C 1.532 0.267 0 C-N-CA 123.645 0.778 . . . . 0.0 110.967 -179.961 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo . . . . . 0 N--CA 1.462 -0.345 0 N-CA-C 114.99 1.112 . . . . 0.0 114.99 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 37.3 t -61.66 -34.33 61.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 119.416 1.007 . . . . 0.0 109.289 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -66.85 -46.5 74.85 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.07 -42.19 89.8 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -61.52 -47.52 85.22 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.28 68.65 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 119.616 1.098 . . . . 0.0 112.244 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 tt -70.89 -51.29 27.13 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -34.68 76.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.557 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.2 tp -66.35 -44.9 81.94 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 124.238 1.015 . . . . 0.0 108.886 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.57 -45.91 90.46 Favored 'General case' 0 C--O 1.227 -0.123 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.94 -43.79 98.12 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.52 -38.07 88.52 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 119.043 -0.504 . . . . 0.0 110.325 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -64.32 -47.84 77.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.1 mt -58.11 -44.67 87.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.2 tp -62.26 -39.52 93.14 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.105 0.562 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.2 -46.45 83.85 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.801 0.728 . . . . 0.0 109.62 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.2 mm -63.93 -40.48 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.8 tp -59.71 -49.69 76.75 Favored 'General case' 0 C--O 1.226 -0.132 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 tt -58.64 -39.52 80.77 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.925 1.29 . . . . 0.0 110.402 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.1 tt -59.5 -54.11 50.36 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.341 1.056 . . . . 0.0 108.459 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 CA--C 1.528 0.127 0 CA-C-O 119.512 -0.28 . . . . 0.0 110.55 179.821 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo . . . . . 0 CA--C 1.534 0.477 0 N-CA-C 115.719 1.392 . . . . 0.0 115.719 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.42 -31.25 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 118.981 0.81 . . . . 0.0 110.621 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -69.82 -48.89 57.35 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.3 mp -55.1 -44.71 75.16 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.95 -53.74 53.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.8 mtt-85 -59.66 -33.75 71.94 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.293 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.36 -25.23 61.44 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 120.074 1.306 . . . . 0.0 109.708 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -40.33 17.77 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.019 -1.051 . . . . 0.0 108.875 177.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.4 tp -65.92 -52.28 51.31 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.799 0.84 . . . . 0.0 109.875 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.74 -44.33 90.46 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 123.175 0.59 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.32 -33.17 71.19 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.573 -0.851 . . . . 0.0 111.346 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.6 tp -67.51 -42.86 82.16 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.78 -45.75 91.2 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.036 0.934 . . . . 0.0 109.099 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.1 tp -60.14 -43.66 95.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.21 -38.63 89.88 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.129 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.37 -43.99 92.79 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.102 0.864 . . . . 0.0 109.146 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.68 -45.52 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.14 -46.89 82.32 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.651 0.78 . . . . 0.0 110.349 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -56.36 -43.94 79.63 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.903 1.281 . . . . 0.0 110.158 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.96 -47.27 72.15 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 CA--C 1.532 0.261 0 C-N-CA 125.0 1.32 . . . . 0.0 110.873 179.409 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 CA--C 1.533 0.461 0 N-CA-C 110.167 -0.744 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.0 m -65.04 -32.84 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 O-C-N 121.808 -0.557 . . . . 0.0 109.772 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -70.42 -41.81 72.42 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.304 0.956 . . . . 0.0 108.986 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.6 mt -60.16 -41.15 92.19 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -61.68 -51.75 67.13 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.974 0.909 . . . . 0.0 108.554 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 -58.85 -36.79 75.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.498 1.519 . . . . 0.0 111.682 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.12 -39.4 72.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -42.5 90.22 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.31 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 tt -62.17 -55.38 29.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 124.025 0.93 . . . . 0.0 108.75 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -55.8 -44.95 78.28 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 123.918 0.887 . . . . 0.0 111.353 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.9 mt -68.45 -37.85 80.58 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.512 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.4 mt -66.78 -42.19 86.43 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.5 tp -63.72 -44.04 94.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.217 0.607 . . . . 0.0 109.705 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.04 -46.43 88.25 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 tp -62.03 -40.93 97.38 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 119.057 -0.497 . . . . 0.0 110.378 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 tt -62.31 -49.26 76.35 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 30.0 mm -60.49 -43.96 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 tt -58.69 -50.62 73.22 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.592 0.757 . . . . 0.0 109.345 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.35 -42.36 86.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 124.529 1.132 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.2 -46.89 81.93 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.315 0.646 . . . . 0.0 109.717 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.9 mt . . . . . 0 N--CA 1.46 0.06 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.977 179.788 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo . . . . . 0 CA--C 1.531 0.367 0 N-CA-C 111.251 -0.327 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.5 -32.88 60.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.631 -0.668 . . . . 0.0 111.018 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -71.97 -41.0 68.23 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.833 1.197 . . . . 0.0 108.831 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 75.4 mt -61.21 -41.47 96.9 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 177.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.9 tptp -62.27 -49.12 76.95 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.604 1.161 . . . . 0.0 109.434 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -60.14 -35.76 76.01 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.436 1.095 . . . . 0.0 110.84 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.5 mt -70.44 -45.7 65.3 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.23 -35.6 81.34 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.781 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -66.4 -45.78 78.83 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.29 -46.63 88.03 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.655 0.782 . . . . 0.0 109.263 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.33 -40.7 97.22 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.062 -0.494 . . . . 0.0 110.353 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.3 tt -63.4 -45.53 90.59 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.8 -43.44 98.79 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.019 0.528 . . . . 0.0 109.957 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.6 tp -60.27 -44.37 95.39 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.7 tt -62.2 -41.37 98.3 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 123.316 0.647 . . . . 0.0 109.796 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.0 tt -63.11 -43.84 97.32 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.65 0.659 . . . . 0.0 109.775 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.7 mt -63.75 -44.8 98.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.15 -48.97 79.65 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.655 0.782 . . . . 0.0 109.245 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.1 tt -55.65 -43.99 76.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.193 1.397 . . . . 0.0 111.089 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 19.2 mt -64.94 -45.12 87.09 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 123.694 0.798 . . . . 0.0 109.358 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.0 mt . . . . . 0 N--CA 1.462 0.136 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.466 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo . . . . . 0 CA--C 1.533 0.434 0 N-CA-C 111.136 -0.371 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -63.4 -27.74 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.51 0.724 . . . . 0.0 110.842 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -69.81 -51.16 36.03 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.92 -41.97 79.13 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -62.86 -47.72 82.14 Favored 'General case' 0 C--N 1.341 0.239 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.78 -40.86 85.21 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.127 0.876 . . . . 0.0 111.701 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.75 -25.83 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 118.879 0.763 . . . . 0.0 110.471 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.8 -40.75 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.348 -0.834 . . . . 0.0 109.932 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.3 tp -64.1 -47.77 78.74 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.909 0.884 . . . . 0.0 109.197 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.6 -43.83 89.69 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.52 -43.45 97.11 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-O 119.093 -0.48 . . . . 0.0 110.348 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.53 -48.51 81.45 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 122.909 0.484 . . . . 0.0 109.727 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.91 -45.01 94.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 119.257 -0.402 . . . . 0.0 110.833 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.14 -46.93 84.79 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.91 -41.33 97.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.564 0.746 . . . . 0.0 110.507 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.1 -50.38 72.14 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.944 0.793 . . . . 0.0 109.948 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 mm -62.65 -43.76 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.48 -49.61 76.72 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 123.269 0.627 . . . . 0.0 109.968 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.3 tp -56.65 -43.12 80.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.335 1.454 . . . . 0.0 111.437 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.8 mt -63.63 -47.59 80.74 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.74 0.816 . . . . 0.0 109.079 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 42.6 mm . . . . . 0 CA--C 1.531 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.185 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo . . . . . 0 N--CA 1.46 -0.494 0 N-CA-C 112.936 0.321 . . . . 0.0 112.936 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -63.49 -31.14 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.36 -0.838 . . . . 0.0 110.538 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -69.22 -46.66 66.85 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.67 -41.91 91.68 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -61.93 -48.5 80.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 118.197 -0.906 . . . . 0.0 108.94 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtt180 -60.15 -30.45 69.32 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.664 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.77 -50.83 39.45 Favored 'General case' 0 C--O 1.226 -0.183 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -36.36 82.34 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.41 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.25 -44.55 83.4 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -58.95 -45.28 90.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -63.05 -41.89 99.59 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.35 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 tt -61.94 -47.27 85.64 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.016 0.526 . . . . 0.0 109.656 179.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 80.5 mt -63.13 -42.11 99.43 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.342 0.657 . . . . 0.0 110.358 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.4 tp -60.62 -47.06 87.92 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -61.26 -40.72 95.13 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 123.475 0.71 . . . . 0.0 110.178 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.1 tt -61.56 -49.19 77.65 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.61 -42.1 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.84 -49.73 76.65 Favored 'General case' 0 C--O 1.226 -0.175 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.8 tp -60.69 -36.38 78.63 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.445 1.098 . . . . 0.0 110.504 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.53 -54.87 37.52 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 179.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.0 mm . . . . . 0 C--O 1.226 -0.155 0 CA-C-O 119.191 -0.433 . . . . 0.0 110.668 179.954 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo . . . . . 0 N--CA 1.461 -0.41 0 N-CA-C 114.0 0.731 . . . . 0.0 114.0 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.76 -35.39 67.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-N 119.145 0.884 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -67.36 -47.3 70.83 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 179.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -57.15 -43.73 82.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.2 -50.51 73.39 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 123.78 0.832 . . . . 0.0 108.865 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -40.35 78.02 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.823 1.249 . . . . 0.0 112.036 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.96 -26.8 61.49 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 124.235 1.014 . . . . 0.0 110.412 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.38 -38.39 20.34 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.247 -0.908 . . . . 0.0 109.453 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.5 tp -64.04 -45.79 87.27 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 124.223 1.009 . . . . 0.0 108.386 178.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.64 -44.76 93.39 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.5 tp -63.36 -43.72 96.85 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.506 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.32 -48.44 81.73 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.02 0.528 . . . . 0.0 109.703 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.2 tp -62.92 -43.16 99.55 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.759 0.424 . . . . 0.0 110.924 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -59.86 -47.24 86.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.3 tp -62.37 -39.71 94.07 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.203 0.601 . . . . 0.0 110.605 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.59 -48.49 79.21 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.574 0.625 . . . . 0.0 109.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.8 -41.04 91.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.8 tp -58.81 -50.39 74.14 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.05 -40.59 85.56 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 0.0 110.236 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -58.83 -56.3 24.02 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.538 1.135 . . . . 0.0 108.955 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.2 mm . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 119.098 -0.477 . . . . 0.0 110.685 -179.735 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo . . . . . 0 N--CA 1.462 -0.335 0 N-CA-C 113.859 0.676 . . . . 0.0 113.859 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.72 -29.8 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 121.4 -0.813 . . . . 0.0 110.114 178.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -69.85 -42.1 74.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.745 1.157 . . . . 0.0 108.311 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.92 -41.33 99.44 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -63.81 -47.54 80.42 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 124.649 1.18 . . . . 0.0 108.51 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -57.55 -35.27 70.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.628 1.971 . . . . 0.0 111.38 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -72.29 -48.86 39.12 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -36.94 81.76 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.924 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -64.97 -44.42 89.42 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 124.166 0.986 . . . . 0.0 108.427 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.86 -44.97 93.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.59 -49.35 75.58 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.889 0.476 . . . . 0.0 110.363 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.9 -38.41 88.26 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.545 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.8 tp -65.14 -43.74 90.91 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.744 0.702 . . . . 0.0 109.703 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -60.72 -45.87 92.58 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.1 tp -61.85 -40.5 95.57 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.034 0.534 . . . . 0.0 110.321 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.66 -47.22 84.63 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 77.8 mt -61.9 -41.98 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.44 -49.67 76.91 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 118.819 0.736 . . . . 0.0 109.337 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.75 -42.37 88.69 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.53 1.132 . . . . 0.0 110.118 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -58.87 -51.56 69.51 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 125.11 1.364 . . . . 0.0 108.637 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.9 mt . . . . . 0 C--N 1.335 -0.049 0 C-N-CA 123.175 0.59 . . . . 0.0 110.179 179.819 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo . . . . . 0 N--CA 1.458 -0.601 0 N-CA-C 114.133 0.782 . . . . 0.0 114.133 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.9 m -63.05 -36.67 76.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 119.363 0.983 . . . . 0.0 111.193 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -71.21 -44.62 65.03 Favored 'General case' 0 C--N 1.339 0.119 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.0 mt -57.75 -43.86 85.71 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.06 -51.5 69.37 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.083 0.953 . . . . 0.0 108.528 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.8 mtp180 -59.97 -34.51 73.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.168 0.894 . . . . 0.0 112.168 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 mt -72.06 -29.23 63.94 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.619 1.099 . . . . 0.0 109.65 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -36.07 21.38 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.008 -1.058 . . . . 0.0 110.255 178.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -64.84 -44.99 88.0 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.651 1.181 . . . . 0.0 108.787 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.34 -41.96 85.76 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 122.827 0.451 . . . . 0.0 109.971 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.19 -46.38 80.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.78 -44.75 96.38 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.76 -43.17 99.38 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.741 0.817 . . . . 0.0 110.321 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.5 tp -59.32 -46.5 88.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.01 -41.41 98.05 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.932 0.493 . . . . 0.0 110.146 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.92 -49.37 76.43 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 123.564 0.746 . . . . 0.0 109.409 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.5 mm -61.87 -40.36 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.91 -47.54 85.91 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.037 0.835 . . . . 0.0 109.246 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.86 -37.38 81.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.424 1.09 . . . . 0.0 110.081 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.11 -50.84 68.9 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.553 1.141 . . . . 0.0 108.12 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.5 mt . . . . . 0 CA--C 1.53 0.19 0 C-N-CA 123.696 0.798 . . . . 0.0 109.821 179.504 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo . . . . . 0 CA--C 1.531 0.369 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.6 m -63.66 -33.28 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.45 -0.781 . . . . 0.0 109.943 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.413 ' CD2' ' HE ' ' A' ' 10' ' ' ARG . 4.6 m80 -72.47 -40.67 66.77 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 119.417 1.008 . . . . 0.0 108.581 178.28 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.83 -44.59 90.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -61.37 -47.3 86.47 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 124.224 1.01 . . . . 0.0 109.602 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.413 ' HE ' ' CD2' ' A' ' 7' ' ' HIS . 27.3 mtp85 -57.89 -34.83 70.22 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 119.68 1.127 . . . . 0.0 111.76 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 mp -71.26 -46.75 60.26 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 119.991 1.269 . . . . 0.0 107.666 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -34.23 77.63 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.986 -0.53 . . . . 0.0 111.253 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.0 tp -67.75 -44.47 77.46 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.053 0.941 . . . . 0.0 108.818 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.92 -45.66 91.88 Favored 'General case' 0 C--O 1.226 -0.151 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.21 -48.11 83.03 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.124 0.57 . . . . 0.0 109.825 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.55 -44.64 93.19 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.36 0.664 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.9 tt -60.6 -43.43 97.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.107 0.963 . . . . 0.0 110.549 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -58.8 -51.46 69.89 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.4 tt -59.96 -40.05 87.69 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.792 0.837 . . . . 0.0 110.633 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -63.6 -43.91 95.52 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.381 0.672 . . . . 0.0 110.117 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.51 -42.87 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.25 -48.8 80.27 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.28 -37.69 78.29 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.084 1.354 . . . . 0.0 110.664 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 tt -59.74 -52.04 67.18 Favored 'General case' 0 C--O 1.23 0.061 0 C-N-CA 124.727 1.211 . . . . 0.0 108.546 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 48.3 mm . . . . . 0 C--O 1.231 0.12 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 179.599 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 N--CA 1.462 -0.378 0 N-CA-C 114.603 0.963 . . . . 0.0 114.603 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -60.58 -30.53 46.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 119.311 0.96 . . . . 0.0 111.001 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -66.68 -50.11 63.93 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 79.0 mt -59.16 -41.84 89.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -60.86 -48.5 81.54 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.293 1.037 . . . . 0.0 109.9 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -62.2 -35.94 80.41 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 119.438 1.017 . . . . 0.0 110.962 179.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 69.1 mt -70.46 -44.81 67.01 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.487 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -64.23 -39.55 94.2 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.646 -0.692 . . . . 0.0 110.182 178.987 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.1 tp -63.1 -48.96 76.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.705 0.802 . . . . 0.0 109.258 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -57.91 -45.23 86.8 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.321 0.648 . . . . 0.0 109.908 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.7 mt -64.58 -42.58 95.53 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.77 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.02 -39.13 92.95 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.502 0.592 . . . . 0.0 109.905 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.2 tp -65.05 -44.12 90.05 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.1 tp -59.58 -45.58 91.45 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.3 -43.39 98.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.452 0.701 . . . . 0.0 109.813 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.47 -49.33 77.97 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-N 118.652 0.66 . . . . 0.0 109.571 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.0 mm -62.74 -39.43 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.0 tp -61.48 -47.91 83.5 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.161 0.891 . . . . 0.0 109.101 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.48 -40.08 85.83 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.977 1.311 . . . . 0.0 109.443 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -61.63 -51.19 69.49 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 124.633 1.173 . . . . 0.0 110.912 179.643 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 N--CA 1.462 -0.381 0 N-CA-C 113.657 0.599 . . . . 0.0 113.657 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.4 t -68.65 -39.02 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.9 m80 -67.78 -38.31 83.2 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 119.092 0.86 . . . . 0.0 109.364 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.5 mt -58.48 -45.27 89.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -52.74 64.46 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.327 1.051 . . . . 0.0 108.851 177.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -55.27 -34.4 64.03 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.785 1.234 . . . . 0.0 112.577 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mp -73.27 -27.52 61.61 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 119.376 0.989 . . . . 0.0 109.86 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.45 -39.5 18.88 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 120.944 -1.097 . . . . 0.0 109.485 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.2 tp -60.74 -41.28 95.06 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 124.947 1.299 . . . . 0.0 108.614 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.82 -41.73 82.82 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.7 mt -71.7 -39.61 70.08 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.13 -37.44 80.06 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 tt -62.93 -48.85 77.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.233 1.013 . . . . 0.0 108.657 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.02 -43.45 86.75 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.4 tp -63.44 -38.24 90.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.066 0.546 . . . . 0.0 110.417 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.8 tp -63.88 -45.15 90.71 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 118.771 0.714 . . . . 0.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.1 mm -63.99 -40.98 91.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.32 -49.1 79.11 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.73 -41.43 86.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.787 1.235 . . . . 0.0 110.265 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.48 -52.09 67.1 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.688 1.195 . . . . 0.0 108.606 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.2 mt . . . . . 0 C--O 1.228 -0.065 0 C-N-CA 123.303 0.641 . . . . 0.0 110.134 179.724 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo . . . . . 0 N--CA 1.456 -0.696 0 CA-C-O 119.091 -0.462 . . . . 0.0 111.838 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.8 t -65.18 -43.74 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -65.34 -44.38 87.93 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.15 -44.22 87.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -59.66 -49.15 78.87 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 178.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.5 84.63 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.767 0.827 . . . . 0.0 112.223 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -74.56 -25.17 59.13 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.921 0.889 . . . . 0.0 110.965 -178.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -38.73 20.05 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 tp -62.88 -46.9 85.67 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.39 -42.76 87.82 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.241 0.616 . . . . 0.0 110.54 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 64.4 tp -64.85 -47.4 78.07 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.032 0.378 . . . . 0.0 110.49 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.21 -42.68 99.53 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.31 -42.98 99.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.285 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.6 tp -58.58 -47.37 84.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.5 tp -62.14 -42.16 98.97 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.642 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.15 -46.34 87.62 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.806 0.442 . . . . 0.0 110.284 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 22.3 mm -62.11 -43.1 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.85 -51.36 70.36 Favored 'General case' 0 N--CA 1.461 0.112 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.33 -43.37 83.3 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.355 1.062 . . . . 0.0 110.868 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.63 -46.05 87.46 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.082 0.553 . . . . 0.0 110.061 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.4 mt . . . . . 0 N--CA 1.461 0.08 0 C-N-CA 123.182 0.593 . . . . 0.0 110.077 179.73 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo . . . . . 0 N--CA 1.454 -0.83 0 N-CA-C 110.569 -0.589 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.7 t -64.59 -48.37 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 123.931 0.892 . . . . 0.0 108.837 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -65.75 -38.18 88.38 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.485 1.038 . . . . 0.0 109.147 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.39 -43.8 98.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -62.77 -47.59 82.84 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.55 1.14 . . . . 0.0 108.292 178.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.3 tpm_? -56.63 -39.32 73.46 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.865 1.666 . . . . 0.0 111.266 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.76 -46.37 58.64 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -38.55 86.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.269 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.5 tp -66.4 -43.65 85.23 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.666 1.186 . . . . 0.0 109.402 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.56 -46.52 89.87 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.9 mt -63.84 -40.12 95.82 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.529 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.0 -46.75 87.85 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.428 0.558 . . . . 0.0 109.856 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.32 -42.44 98.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.193 0.452 . . . . 0.0 110.338 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -60.16 -47.01 87.72 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 tt -60.82 -41.09 95.07 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 123.841 0.856 . . . . 0.0 110.41 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.16 -49.18 76.88 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 118.481 0.582 . . . . 0.0 109.868 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.0 mm -64.11 -38.48 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.98 -49.44 77.43 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.032 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.09 -39.79 83.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.902 1.281 . . . . 0.0 109.933 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -61.26 -53.46 56.52 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.53 0.177 0 C-N-CA 123.817 0.847 . . . . 0.0 110.935 -179.598 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.8 tt . . . . . 0 N--CA 1.474 0.727 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -68.33 168.79 18.48 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 CA-C-N 120.857 1.342 . . . . 0.0 109.513 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 p -134.09 119.6 19.12 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -54.82 141.46 57.48 Favored Pre-proline 0 CA--C 1.539 0.521 0 C-N-CA 123.171 0.588 . . . . 0.0 110.046 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -61.12 -24.28 78.96 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.301 2.001 . . . . 0.0 112.543 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.53 -35.18 68.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.524 -0.735 . . . . 0.0 109.468 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -64.31 -50.04 69.42 Favored 'General case' 0 C--N 1.342 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.96 -40.08 87.81 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -59.06 -50.93 72.18 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -34.84 78.67 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.434 1.015 . . . . 0.0 111.156 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.3 tp -69.45 -31.16 69.3 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 119.244 0.929 . . . . 0.0 109.633 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -35.4 22.81 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.153 -0.967 . . . . 0.0 109.973 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.89 -46.77 83.42 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -58.08 -44.35 87.52 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.334 0.654 . . . . 0.0 109.916 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 tp -63.77 -44.32 93.75 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.4 -42.09 99.16 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.88 -44.5 95.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.337 0.655 . . . . 0.0 109.679 179.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.5 tt -57.82 -50.06 74.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.9 tp -60.61 -38.77 85.79 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.535 0.734 . . . . 0.0 111.078 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.58 -48.9 75.5 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.8 mt -61.37 -41.09 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.8 tt -59.35 -51.11 71.34 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.09 -39.93 83.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.809 1.244 . . . . 0.0 110.468 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -59.42 -52.09 67.08 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.413 1.085 . . . . 0.0 108.404 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 77.7 mt -64.72 -35.44 74.93 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.064 0 C-N-CA 123.034 0.534 . . . . 0.0 109.912 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.1 tp -64.77 -14.24 58.21 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.848 0.749 . . . . 0.0 109.304 177.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.89 -47.13 5.43 Favored Glycine 0 C--N 1.34 0.766 0 N-CA-C 107.307 -2.317 . . . . 0.0 107.307 178.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.57 74.24 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.123 0.969 . . . . 0.0 109.106 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.78 -29.17 62.38 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.925 1.29 . . . . 0.0 110.662 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.7 mt -69.83 -24.44 63.45 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.59 -0.694 . . . . 0.0 111.005 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.9 mt -89.78 -29.14 18.87 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 125.208 1.403 . . . . 0.0 109.094 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 107.42 -3.76 34.87 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 125.863 1.697 . . . . 0.0 113.027 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.2 tp . . . . . 0 C--O 1.25 1.12 0 CA-C-O 116.264 -1.827 . . . . 0.0 106.215 179.632 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 70.9 mt . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 105.11 -2.181 . . . . 0.0 105.11 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -75.54 45.99 1.55 Allowed 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.889 3.059 . . . . 0.0 111.868 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.2 m -61.63 -39.34 90.97 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.118 1.367 . . . . 0.0 113.887 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -59.92 135.18 90.09 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.145 0.578 . . . . 0.0 109.84 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -58.45 -25.49 73.94 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.706 2.271 . . . . 0.0 113.504 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -62.75 -33.19 58.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.416 -0.802 . . . . 0.0 109.742 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -71.56 -40.53 69.92 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -59.74 -44.0 93.97 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -62.13 -47.58 83.95 Favored 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.778 1.231 . . . . 0.0 108.978 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -58.84 -36.41 74.51 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.144 1.378 . . . . 0.0 111.372 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -73.4 -48.18 35.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.47 -36.13 79.56 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.663 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.67 -44.26 86.79 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.94 -45.22 93.31 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -58.9 -50.38 74.24 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.873 0.869 . . . . 0.0 109.674 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.1 -45.03 83.74 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.761 0.825 . . . . 0.0 110.023 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.1 mt -62.61 -43.26 99.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.5 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.42 -45.13 94.72 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 119.005 0.82 . . . . 0.0 108.983 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.6 -42.42 98.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.22 0.608 . . . . 0.0 110.059 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.55 -48.78 79.45 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 123.472 0.709 . . . . 0.0 109.422 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.73 -42.65 95.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 123.726 0.81 . . . . 0.0 109.191 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -59.41 -49.43 77.84 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 118.741 0.7 . . . . 0.0 109.529 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 61.8 tp -59.85 -39.75 86.25 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.322 1.049 . . . . 0.0 110.125 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.65 -52.13 66.43 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.651 1.18 . . . . 0.0 108.418 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.0 mt -62.56 -32.59 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.071 0 C-N-CA 123.372 0.669 . . . . 0.0 109.865 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -14.77 51.18 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.969 0.804 . . . . 0.0 110.227 178.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.86 -38.92 10.86 Favored Glycine 0 C--N 1.34 0.792 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.4 -45.04 66.75 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 52.0 tp -59.57 -27.31 66.14 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.605 1.162 . . . . 0.0 110.939 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.88 -31.07 72.13 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.522 1.129 . . . . 0.0 110.088 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.9 tp -93.65 -29.2 15.57 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.04 1.336 . . . . 0.0 109.728 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 108.39 50.45 0.76 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.332 1.444 . . . . 0.0 111.346 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.0 tt . . . . . 0 C--O 1.246 0.872 0 C-N-CA 125.955 1.702 . . . . 0.0 107.113 179.487 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 25.6 pt . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 117.478 -1.248 . . . . 0.0 107.778 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -76.99 72.83 5.68 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.399 2.732 . . . . 0.0 111.324 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.3 p -152.68 129.21 10.71 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -58.89 141.95 85.14 Favored Pre-proline 0 C--O 1.239 0.511 0 C-N-CA 123.713 0.805 . . . . 0.0 110.961 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -61.67 -26.34 79.99 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.473 2.115 . . . . 0.0 112.103 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.01 -31.98 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 O-C-N 121.429 -0.794 . . . . 0.0 110.44 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -71.16 -39.81 71.69 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.014 1.279 . . . . 0.0 107.862 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.79 -43.07 99.76 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -62.13 -46.79 87.43 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.86 1.264 . . . . 0.0 108.698 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -57.3 -36.78 71.49 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.006 1.722 . . . . 0.0 111.231 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.7 tp -72.64 -49.79 29.51 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -35.77 73.6 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 118.933 -0.556 . . . . 0.0 111.475 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.7 tp -67.77 -43.42 79.85 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.322 1.049 . . . . 0.0 109.255 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -61.67 -47.44 85.36 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.1 mt -63.29 -42.6 99.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.903 0.481 . . . . 0.0 110.229 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.63 -45.5 93.81 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.85 -42.56 99.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.696 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.5 -53.42 57.67 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.78 -44.18 94.03 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.774 0.83 . . . . 0.0 110.849 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.34 -49.64 76.8 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.204 0.602 . . . . 0.0 110.743 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.9 mm -64.47 -38.72 83.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.3 tp -60.69 -49.41 77.61 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.82 -41.96 92.43 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.997 1.319 . . . . 0.0 109.821 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 tt -59.29 -52.32 66.18 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 124.392 1.077 . . . . 0.0 108.622 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 89.5 mt -63.7 -30.63 50.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 123.601 0.76 . . . . 0.0 110.655 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.6 tt -63.92 -16.56 61.76 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.249 0.931 . . . . 0.0 108.842 177.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -67.5 -35.63 87.09 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.37 -48.04 79.56 Favored 'General case' 0 C--O 1.224 -0.244 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.26 -32.42 72.23 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.54 -0.725 . . . . 0.0 110.945 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -79.33 -14.15 59.18 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.061 1.744 . . . . 0.0 112.867 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 96.9 mt -115.75 -29.04 6.54 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.869 1.213 . . . . 0.0 112.989 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 114.82 -14.76 19.55 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 126.468 1.985 . . . . 0.0 112.068 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.252 1.209 0 C-N-CA 127.468 2.307 . . . . 0.0 105.476 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 36.5 mm . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -64.0 -36.87 46.53 Favored 'Trans proline' 0 CA--C 1.533 0.469 0 C-N-CA 122.146 1.897 . . . . 0.0 111.963 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.7 m 51.93 21.45 1.48 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.01 140.32 9.0 Favored Pre-proline 0 C--O 1.239 0.506 0 C-N-CA 125.443 1.497 . . . . 0.0 111.526 -179.246 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.07 -29.86 88.39 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.516 2.144 . . . . 0.0 112.575 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.66 -29.68 47.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 121.363 -0.835 . . . . 0.0 110.791 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -69.8 -49.08 56.23 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.64 -42.76 84.07 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -60.82 -47.05 88.12 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.239 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 -58.57 -36.97 74.77 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 119.662 1.119 . . . . 0.0 111.657 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -71.61 -48.13 50.05 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.39 -33.22 75.06 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.642 -0.694 . . . . 0.0 111.913 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.0 tp -67.46 -48.81 66.12 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.28 -48.48 80.34 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.272 0.629 . . . . 0.0 109.308 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.4 tp -59.51 -46.69 88.12 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.568 0.747 . . . . 0.0 110.684 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.89 -44.89 95.88 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.11 0.414 . . . . 0.0 110.573 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.74 -43.72 95.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.208 0.458 . . . . 0.0 110.365 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.1 tp -59.88 -47.08 87.2 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.95 -41.13 95.71 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.644 0.778 . . . . 0.0 110.473 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.42 -50.67 70.57 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -61.67 -40.89 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.94 -52.2 66.77 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.02 -40.22 80.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.675 1.19 . . . . 0.0 110.556 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.44 -57.01 14.84 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.424 1.09 . . . . 0.0 108.879 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.8 mm -65.4 -28.43 44.39 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.997 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 46.2 tp -64.36 -17.16 63.46 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.068 0.849 . . . . 0.0 109.061 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.9 -49.82 5.85 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.83 -41.29 82.0 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.929 0.892 . . . . 0.0 109.761 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 67.1 mt -62.36 -15.29 47.61 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.746 0.818 . . . . 0.0 112.688 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 93.4 mt -102.36 -4.97 24.72 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.711 1.205 . . . . 0.0 111.434 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.8 tt -117.02 -29.54 5.94 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.524 1.13 . . . . 0.0 111.714 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 102.7 -5.1 50.76 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 125.38 1.467 . . . . 0.0 112.99 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 C--O 1.252 1.236 0 C-N-CA 127.812 2.445 . . . . 0.0 105.715 179.412 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 79.5 mt . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -62.37 -46.63 11.68 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.24 1.96 . . . . 0.0 111.724 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 t 49.5 13.35 0.08 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.67 1.988 . . . . 0.0 116.227 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.94 138.0 55.15 Favored Pre-proline 0 CA--C 1.538 0.49 0 C-N-CA 125.108 1.363 . . . . 0.0 110.528 -179.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -56.55 -34.56 95.48 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.742 2.295 . . . . 0.0 112.965 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.8 t -62.11 -44.6 99.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -41.06 97.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.11 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.89 -44.28 94.32 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.5 tptp -58.9 -51.24 70.89 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.384 1.074 . . . . 0.0 108.596 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -35.93 75.4 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 124.679 1.192 . . . . 0.0 111.605 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.7 mt -73.39 -27.17 61.32 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 119.057 0.844 . . . . 0.0 109.909 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -38.97 18.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.033 -1.042 . . . . 0.0 109.908 178.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.71 -47.57 85.69 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.554 1.542 . . . . 0.0 108.491 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -54.98 -41.19 70.87 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 122.79 0.436 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -71.32 -43.0 67.88 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.622 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.79 -41.96 96.61 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 118.164 0.438 . . . . 0.0 110.023 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tt -64.96 -45.45 85.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.591 1.156 . . . . 0.0 110.062 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.9 tp -60.51 -45.43 93.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.09 -39.66 93.22 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.404 0.681 . . . . 0.0 110.452 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.51 -48.01 81.43 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 118.861 0.755 . . . . 0.0 109.173 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.7 mt -60.68 -45.04 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -57.87 -50.96 71.54 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.778 0.831 . . . . 0.0 109.539 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.15 -42.06 85.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.747 1.219 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.55 -47.06 83.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.073 0.549 . . . . 0.0 109.693 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.92 -32.78 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.8 tp -63.5 -16.49 60.86 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -80.86 -28.12 47.6 Favored Glycine 0 C--N 1.342 0.895 0 N-CA-C 109.938 -1.265 . . . . 0.0 109.938 178.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.11 -48.44 35.63 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.4 mt -58.86 -38.46 78.83 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 123.814 0.846 . . . . 0.0 109.83 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.5 tp -62.75 -21.98 66.22 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.593 1.557 . . . . 0.0 111.107 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mp -103.32 -7.3 21.19 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.061 1.745 . . . . 0.0 111.052 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.61 32.74 7.91 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-O 118.159 -1.356 . . . . 0.0 114.122 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.4 tt . . . . . 0 C--O 1.247 0.943 0 CA-C-N 119.19 1.495 . . . . 0.0 108.786 179.556 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.8 tt . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -69.16 168.5 20.58 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 121.278 1.319 . . . . 0.0 109.612 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.8 t -159.0 170.14 22.75 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.5 138.7 59.86 Favored Pre-proline 0 CA--C 1.539 0.555 0 C-N-CA 123.98 0.912 . . . . 0.0 109.724 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.88 -29.28 85.77 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.517 2.145 . . . . 0.0 113.512 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.8 m -63.15 -35.43 71.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 119.153 0.888 . . . . 0.0 110.96 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 -70.44 -46.78 63.22 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.52 -44.07 80.43 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.7 tptt -59.42 -51.8 68.33 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.799 0.84 . . . . 0.0 108.799 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -60.21 -34.75 74.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.137 0.881 . . . . 0.0 111.87 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mp -70.6 -28.27 64.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 119.529 1.058 . . . . 0.0 109.666 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -40.06 16.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.138 -0.976 . . . . 0.0 109.983 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.1 tp -60.8 -43.67 97.86 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.92 1.288 . . . . 0.0 108.837 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.69 -41.06 80.86 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.887 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.0 mt -69.62 -43.79 71.98 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.161 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.13 -43.5 95.64 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 118.076 0.398 . . . . 0.0 109.947 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 tp -65.2 -44.34 88.68 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.889 0.875 . . . . 0.0 110.3 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.2 tp -59.77 -45.17 93.07 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 tt -62.01 -42.21 98.91 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.374 0.67 . . . . 0.0 109.981 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 tp -62.3 -46.65 87.78 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.486 0.584 . . . . 0.0 109.893 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.9 mt -63.9 -41.57 92.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.06 -49.52 77.57 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.931 0.787 . . . . 0.0 109.086 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.88 -42.39 84.5 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.894 1.278 . . . . 0.0 109.814 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -59.48 -55.44 34.59 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.741 1.216 . . . . 0.0 108.774 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 47.1 mm -63.0 -23.96 34.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 123.645 0.778 . . . . 0.0 110.967 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.74 -17.95 63.55 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.372 0.987 . . . . 0.0 109.336 178.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.69 -37.56 76.82 Favored Glycine 0 C--N 1.341 0.85 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.06 -33.4 73.25 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 117.755 0.777 . . . . 0.0 109.704 179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.38 -15.36 57.26 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.074 0.95 . . . . 0.0 111.547 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 68.9 mt -102.26 -6.44 23.13 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.856 1.262 . . . . 0.0 112.172 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 tt -121.38 -29.5 4.44 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.328 0.967 . . . . 0.0 112.763 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.4 -4.07 43.72 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.489 1.519 . . . . 0.0 112.332 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.3 tp . . . . . 0 C--O 1.246 0.901 0 C-N-CA 127.719 2.408 . . . . 0.0 106.138 179.514 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 44.0 mm . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -55.12 104.78 0.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 123.524 2.816 . . . . 0.0 110.272 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.0 t -167.79 -63.57 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 105.504 -2.036 . . . . 0.0 105.504 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.21 140.28 78.69 Favored Pre-proline 0 C--O 1.239 0.525 0 CA-C-O 117.732 -1.128 . . . . 0.0 108.8 -179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -54.33 -26.72 44.92 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.471 2.781 . . . . 0.0 114.99 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 37.3 t -61.66 -34.33 61.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 119.416 1.007 . . . . 0.0 109.289 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -66.85 -46.5 74.85 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.07 -42.19 89.8 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -61.52 -47.52 85.22 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.28 68.65 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 119.616 1.098 . . . . 0.0 112.244 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 tt -70.89 -51.29 27.13 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -34.68 76.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.557 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.2 tp -66.35 -44.9 81.94 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 124.238 1.015 . . . . 0.0 108.886 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.57 -45.91 90.46 Favored 'General case' 0 C--O 1.227 -0.123 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.94 -43.79 98.12 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.52 -38.07 88.52 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 119.043 -0.504 . . . . 0.0 110.325 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -64.32 -47.84 77.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.1 mt -58.11 -44.67 87.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.2 tp -62.26 -39.52 93.14 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.105 0.562 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.2 -46.45 83.85 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.801 0.728 . . . . 0.0 109.62 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.2 mm -63.93 -40.48 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.8 tp -59.71 -49.69 76.75 Favored 'General case' 0 C--O 1.226 -0.132 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 tt -58.64 -39.52 80.77 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.925 1.29 . . . . 0.0 110.402 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.1 tt -59.5 -54.11 50.36 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.341 1.056 . . . . 0.0 108.459 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.8 mm -65.11 -32.29 57.61 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 CA-C-O 119.512 -0.28 . . . . 0.0 110.55 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 41.8 tp -65.89 -15.38 62.9 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.89 0.768 . . . . 0.0 108.963 177.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.72 -47.02 5.52 Favored Glycine 0 C--N 1.34 0.788 0 N-CA-C 107.391 -2.283 . . . . 0.0 107.391 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.45 -40.33 74.64 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.3 mp -58.86 -17.98 28.71 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.713 1.205 . . . . 0.0 113.201 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.5 mt -76.79 -23.65 52.85 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.596 1.089 . . . . 0.0 111.131 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -121.34 -15.35 8.12 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.21 1.004 . . . . 0.0 113.514 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.04 14.74 60.19 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.277 -1.291 . . . . 0.0 113.632 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.9 tp . . . . . 0 C--O 1.246 0.91 0 C-N-CA 125.704 1.602 . . . . 0.0 107.243 179.934 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 17.5 tt . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -74.54 62.85 5.51 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.697 2.932 . . . . 0.0 112.123 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.6 m -103.0 -14.7 16.36 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.86 150.46 77.1 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-N 119.487 1.039 . . . . 0.0 108.637 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -52.84 -30.67 48.43 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.571 2.847 . . . . 0.0 115.719 -178.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.42 -31.25 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 118.981 0.81 . . . . 0.0 110.621 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -69.82 -48.89 57.35 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.3 mp -55.1 -44.71 75.16 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.95 -53.74 53.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.8 mtt-85 -59.66 -33.75 71.94 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.293 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.36 -25.23 61.44 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 120.074 1.306 . . . . 0.0 109.708 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -40.33 17.77 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.019 -1.051 . . . . 0.0 108.875 177.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.4 tp -65.92 -52.28 51.31 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.799 0.84 . . . . 0.0 109.875 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.74 -44.33 90.46 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 123.175 0.59 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.32 -33.17 71.19 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.573 -0.851 . . . . 0.0 111.346 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.6 tp -67.51 -42.86 82.16 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.78 -45.75 91.2 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.036 0.934 . . . . 0.0 109.099 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.1 tp -60.14 -43.66 95.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.21 -38.63 89.88 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.129 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.37 -43.99 92.79 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.102 0.864 . . . . 0.0 109.146 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.68 -45.52 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.14 -46.89 82.32 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.651 0.78 . . . . 0.0 110.349 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -56.36 -43.94 79.63 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.903 1.281 . . . . 0.0 110.158 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.96 -47.27 72.15 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.6 mm -61.23 -23.08 29.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 125.0 1.32 . . . . 0.0 110.873 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.64 -23.7 52.63 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.07 0.85 . . . . 0.0 109.021 178.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.82 -51.02 31.8 Favored Glycine 0 C--N 1.343 0.919 0 N-CA-C 108.549 -1.82 . . . . 0.0 108.549 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.53 97.13 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.311 0.645 . . . . 0.0 109.407 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.3 mt -60.38 -23.99 64.75 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 117.992 -1.004 . . . . 0.0 112.798 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 pp -102.41 -6.99 22.36 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.593 1.088 . . . . 0.0 111.924 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.7 tp -101.73 -29.43 11.9 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.167 1.387 . . . . 0.0 111.327 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.16 -1.62 59.22 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.189 1.376 . . . . 0.0 112.86 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 C--O 1.252 1.206 0 C-N-CA 127.226 2.21 . . . . 0.0 106.005 179.498 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 32.1 mm . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 106.086 -1.82 . . . . 0.0 106.086 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.57 175.88 8.89 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.493 2.129 . . . . 0.0 110.024 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.3 t -157.23 173.07 17.51 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.39 152.72 63.29 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-O 118.281 -0.866 . . . . 0.0 108.98 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.01 -43.43 42.9 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 121.716 1.611 . . . . 0.0 110.167 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.0 m -65.04 -32.84 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 O-C-N 121.808 -0.557 . . . . 0.0 109.772 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -70.42 -41.81 72.42 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.304 0.956 . . . . 0.0 108.986 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.6 mt -60.16 -41.15 92.19 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -61.68 -51.75 67.13 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.974 0.909 . . . . 0.0 108.554 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 -58.85 -36.79 75.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.498 1.519 . . . . 0.0 111.682 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.12 -39.4 72.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -42.5 90.22 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.31 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 tt -62.17 -55.38 29.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 124.025 0.93 . . . . 0.0 108.75 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -55.8 -44.95 78.28 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 123.918 0.887 . . . . 0.0 111.353 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.9 mt -68.45 -37.85 80.58 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.512 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.4 mt -66.78 -42.19 86.43 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.5 tp -63.72 -44.04 94.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.217 0.607 . . . . 0.0 109.705 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.04 -46.43 88.25 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 tp -62.03 -40.93 97.38 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 119.057 -0.497 . . . . 0.0 110.378 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 tt -62.31 -49.26 76.35 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 30.0 mm -60.49 -43.96 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 tt -58.69 -50.62 73.22 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.592 0.757 . . . . 0.0 109.345 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.35 -42.36 86.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 124.529 1.132 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.2 -46.89 81.93 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.315 0.646 . . . . 0.0 109.717 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.9 mt -64.98 -32.7 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.06 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.977 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 48.4 tp -63.18 -16.93 61.68 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.193 0.906 . . . . 0.0 109.262 177.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.27 -27.31 49.2 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.497 1.046 . . . . 0.0 110.696 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.19 -46.73 10.8 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 178.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 tp -54.64 -41.14 69.71 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 125.51 1.524 . . . . 0.0 112.067 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 pp -66.5 -8.03 23.74 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.01 -1.85 12.96 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.38 2.272 . . . . 0.0 110.073 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 79.79 34.37 31.19 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.138 -0.812 . . . . 0.0 111.745 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.2 mt . . . . . 0 C--O 1.248 1.019 0 C-N-CA 126.506 1.922 . . . . 0.0 109.175 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 23.3 pt . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 117.778 -1.106 . . . . 0.0 108.389 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.96 7.05 3.41 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.062 3.175 . . . . 0.0 114.369 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -60.91 -0.43 0.3 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.994 2.118 . . . . 0.0 116.596 -178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.11 145.91 88.98 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-N 120.85 1.659 . . . . 0.0 108.014 179.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -56.76 -47.2 24.62 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 121.967 1.778 . . . . 0.0 111.251 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.5 -32.88 60.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.631 -0.668 . . . . 0.0 111.018 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -71.97 -41.0 68.23 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.833 1.197 . . . . 0.0 108.831 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 75.4 mt -61.21 -41.47 96.9 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 177.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.9 tptp -62.27 -49.12 76.95 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.604 1.161 . . . . 0.0 109.434 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -60.14 -35.76 76.01 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.436 1.095 . . . . 0.0 110.84 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.5 mt -70.44 -45.7 65.3 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.23 -35.6 81.34 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.781 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -66.4 -45.78 78.83 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.29 -46.63 88.03 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.655 0.782 . . . . 0.0 109.263 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.33 -40.7 97.22 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.062 -0.494 . . . . 0.0 110.353 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.3 tt -63.4 -45.53 90.59 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.8 -43.44 98.79 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.019 0.528 . . . . 0.0 109.957 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.6 tp -60.27 -44.37 95.39 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.7 tt -62.2 -41.37 98.3 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 123.316 0.647 . . . . 0.0 109.796 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.0 tt -63.11 -43.84 97.32 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.65 0.659 . . . . 0.0 109.775 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.7 mt -63.75 -44.8 98.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.15 -48.97 79.65 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.655 0.782 . . . . 0.0 109.245 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.1 tt -55.65 -43.99 76.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.193 1.397 . . . . 0.0 111.089 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 19.2 mt -64.94 -45.12 87.09 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 123.694 0.798 . . . . 0.0 109.358 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.0 mt -65.5 -33.04 60.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.136 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 43.3 tp -66.09 -14.98 62.67 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 118.854 0.752 . . . . 0.0 108.98 177.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.2 -51.71 3.46 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 106.792 -2.523 . . . . 0.0 106.792 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.57 -38.08 68.89 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.201 1.0 . . . . 0.0 110.042 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.6 tt -58.12 -24.23 57.97 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 125.505 1.522 . . . . 0.0 112.064 179.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.7 mt -102.1 -4.9 25.16 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.442 1.497 . . . . 0.0 112.205 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.4 tp -112.58 -29.18 7.55 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.908 1.283 . . . . 0.0 112.297 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.95 5.51 68.07 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.587 1.089 . . . . 0.0 111.825 -178.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--O 1.247 0.951 0 C-N-CA 128.147 2.579 . . . . 0.0 104.641 179.715 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 44.9 pt . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 117.216 -1.373 . . . . 0.0 108.014 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -69.74 162.77 40.76 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 121.479 1.453 . . . . 0.0 109.585 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t -167.28 173.09 9.23 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 179.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.8 m -55.5 143.89 55.76 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 123.716 0.807 . . . . 0.0 110.067 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -59.85 -34.21 95.66 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 121.901 1.734 . . . . 0.0 111.136 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -63.4 -27.74 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.51 0.724 . . . . 0.0 110.842 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -69.81 -51.16 36.03 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.92 -41.97 79.13 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -62.86 -47.72 82.14 Favored 'General case' 0 C--N 1.341 0.239 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.78 -40.86 85.21 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.127 0.876 . . . . 0.0 111.701 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.75 -25.83 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 118.879 0.763 . . . . 0.0 110.471 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.8 -40.75 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.348 -0.834 . . . . 0.0 109.932 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.3 tp -64.1 -47.77 78.74 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.909 0.884 . . . . 0.0 109.197 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.6 -43.83 89.69 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.52 -43.45 97.11 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-O 119.093 -0.48 . . . . 0.0 110.348 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.53 -48.51 81.45 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 122.909 0.484 . . . . 0.0 109.727 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.91 -45.01 94.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 119.257 -0.402 . . . . 0.0 110.833 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.14 -46.93 84.79 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.91 -41.33 97.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.564 0.746 . . . . 0.0 110.507 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.1 -50.38 72.14 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.944 0.793 . . . . 0.0 109.948 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 mm -62.65 -43.76 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.48 -49.61 76.72 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 123.269 0.627 . . . . 0.0 109.968 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.3 tp -56.65 -43.12 80.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.335 1.454 . . . . 0.0 111.437 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.8 mt -63.63 -47.59 80.74 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.74 0.816 . . . . 0.0 109.079 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 42.6 mm -65.44 -28.93 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.74 -16.28 63.63 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.066 0.848 . . . . 0.0 109.044 177.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.68 -52.83 3.22 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 106.932 -2.467 . . . . 0.0 106.932 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.71 -37.67 68.71 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.656 0.783 . . . . 0.0 110.397 179.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.3 tt -58.56 -23.74 59.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.291 1.437 . . . . 0.0 112.013 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.1 mt -102.25 -7.64 21.96 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.212 1.405 . . . . 0.0 112.415 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.4 mp -111.13 -27.98 8.49 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.758 1.223 . . . . 0.0 112.431 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.85 -5.08 79.22 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 125.282 1.42 . . . . 0.0 111.726 -178.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 C--O 1.246 0.884 0 C-N-CA 129.132 2.973 . . . . 0.0 104.344 179.361 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 46.6 pt . . . . . 0 N--CA 1.476 0.862 0 CA-C-O 117.24 -1.362 . . . . 0.0 108.08 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -69.98 170.59 16.47 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 121.525 1.483 . . . . 0.0 109.022 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.7 p -154.07 166.49 32.87 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.63 136.07 82.51 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 123.691 0.796 . . . . 0.0 110.175 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -60.13 -25.22 79.33 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.369 2.046 . . . . 0.0 112.936 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -63.49 -31.14 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.36 -0.838 . . . . 0.0 110.538 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -69.22 -46.66 66.85 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.67 -41.91 91.68 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -61.93 -48.5 80.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 118.197 -0.906 . . . . 0.0 108.94 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtt180 -60.15 -30.45 69.32 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.664 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.77 -50.83 39.45 Favored 'General case' 0 C--O 1.226 -0.183 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -36.36 82.34 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.41 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.25 -44.55 83.4 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -58.95 -45.28 90.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -63.05 -41.89 99.59 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.35 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 tt -61.94 -47.27 85.64 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.016 0.526 . . . . 0.0 109.656 179.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 80.5 mt -63.13 -42.11 99.43 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.342 0.657 . . . . 0.0 110.358 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.4 tp -60.62 -47.06 87.92 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -61.26 -40.72 95.13 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 123.475 0.71 . . . . 0.0 110.178 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.1 tt -61.56 -49.19 77.65 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.61 -42.1 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.84 -49.73 76.65 Favored 'General case' 0 C--O 1.226 -0.175 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.8 tp -60.69 -36.38 78.63 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.445 1.098 . . . . 0.0 110.504 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.53 -54.87 37.52 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 179.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.0 mm -65.93 -30.17 49.17 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.155 0 CA-C-O 119.191 -0.433 . . . . 0.0 110.668 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.09 -20.81 64.42 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.443 1.02 . . . . 0.0 108.754 177.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.71 -44.87 5.65 Favored Glycine 0 C--N 1.34 0.802 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.85 -41.37 86.83 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.037 0.935 . . . . 0.0 110.042 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.6 mt -60.54 -22.62 63.83 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 124.612 1.165 . . . . 0.0 112.157 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.9 mt -67.21 -23.06 65.69 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.44 1.018 . . . . 0.0 109.665 178.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.7 mp -106.91 -3.19 20.48 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.39 1.876 . . . . 0.0 109.987 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.06 24.93 39.07 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 118.612 -1.104 . . . . 0.0 113.087 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp . . . . . 0 C--O 1.25 1.12 0 C-N-CA 125.502 1.521 . . . . 0.0 109.254 179.61 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 32.5 mm . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -72.85 75.55 2.65 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 123.225 2.617 . . . . 0.0 110.305 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 p -149.64 -56.7 0.19 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.716 0.807 . . . . 0.0 109.929 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.98 133.91 87.29 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -55.59 -29.82 71.83 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.727 2.285 . . . . 0.0 114.0 -178.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.76 -35.39 67.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-N 119.145 0.884 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -67.36 -47.3 70.83 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 179.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -57.15 -43.73 82.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.2 -50.51 73.39 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 123.78 0.832 . . . . 0.0 108.865 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -40.35 78.02 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.823 1.249 . . . . 0.0 112.036 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.96 -26.8 61.49 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 124.235 1.014 . . . . 0.0 110.412 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.38 -38.39 20.34 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.247 -0.908 . . . . 0.0 109.453 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.5 tp -64.04 -45.79 87.27 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 124.223 1.009 . . . . 0.0 108.386 178.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.64 -44.76 93.39 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.5 tp -63.36 -43.72 96.85 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.506 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.32 -48.44 81.73 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.02 0.528 . . . . 0.0 109.703 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.2 tp -62.92 -43.16 99.55 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.759 0.424 . . . . 0.0 110.924 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -59.86 -47.24 86.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.3 tp -62.37 -39.71 94.07 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.203 0.601 . . . . 0.0 110.605 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.59 -48.49 79.21 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.574 0.625 . . . . 0.0 109.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.8 -41.04 91.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.8 tp -58.81 -50.39 74.14 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.05 -40.59 85.56 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 0.0 110.236 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -58.83 -56.3 24.02 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.538 1.135 . . . . 0.0 108.955 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.2 mm -64.26 -31.87 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.091 0 CA-C-O 119.098 -0.477 . . . . 0.0 110.685 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 40.3 tp -62.99 -15.66 57.05 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.213 0.915 . . . . 0.0 109.911 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.11 -37.43 18.54 Favored Glycine 0 C--N 1.339 0.745 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 178.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.81 -38.19 88.29 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -57.55 -21.25 37.28 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.766 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 84.5 mt -66.24 -28.82 69.02 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.977 1.262 . . . . 0.0 109.937 178.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tt -85.01 -13.34 50.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.57 1.548 . . . . 0.0 109.204 178.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 122.19 -22.92 7.41 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 127.345 2.403 . . . . 0.0 112.47 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.246 0.907 0 CA-C-N 119.597 1.699 . . . . 0.0 107.299 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.51 156.74 54.84 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 121.741 1.627 . . . . 0.0 108.821 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.7 p -131.23 -83.9 0.52 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.536 0.335 . . . . 0.0 111.875 -178.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -53.84 149.88 15.74 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 125.0 1.32 . . . . 0.0 111.247 -178.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -56.21 -27.41 65.92 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.177 2.585 . . . . 0.0 113.859 -178.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.72 -29.8 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 121.4 -0.813 . . . . 0.0 110.114 178.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -69.85 -42.1 74.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.745 1.157 . . . . 0.0 108.311 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.92 -41.33 99.44 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -63.81 -47.54 80.42 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 124.649 1.18 . . . . 0.0 108.51 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -57.55 -35.27 70.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.628 1.971 . . . . 0.0 111.38 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -72.29 -48.86 39.12 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -36.94 81.76 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.924 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -64.97 -44.42 89.42 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 124.166 0.986 . . . . 0.0 108.427 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.86 -44.97 93.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.59 -49.35 75.58 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.889 0.476 . . . . 0.0 110.363 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.9 -38.41 88.26 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.545 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.8 tp -65.14 -43.74 90.91 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.744 0.702 . . . . 0.0 109.703 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -60.72 -45.87 92.58 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.1 tp -61.85 -40.5 95.57 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.034 0.534 . . . . 0.0 110.321 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.66 -47.22 84.63 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 77.8 mt -61.9 -41.98 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.44 -49.67 76.91 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 118.819 0.736 . . . . 0.0 109.337 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.75 -42.37 88.69 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.53 1.132 . . . . 0.0 110.118 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -58.87 -51.56 69.51 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 125.11 1.364 . . . . 0.0 108.637 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.9 -33.01 58.03 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.049 0 C-N-CA 123.175 0.59 . . . . 0.0 110.179 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.32 -16.46 62.24 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.189 0.904 . . . . 0.0 109.59 177.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.59 -37.89 8.5 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 178.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.2 -50.89 51.26 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 178.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 73.6 mt -56.01 -22.04 24.77 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 125.345 1.458 . . . . 0.0 112.307 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.92 -34.37 75.95 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.389 1.076 . . . . 0.0 108.782 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -85.83 -11.47 53.31 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.239 1.416 . . . . 0.0 110.446 178.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 121.15 -15.34 9.41 Favored Glycine 0 CA--C 1.529 0.969 0 C-N-CA 126.093 1.806 . . . . 0.0 114.624 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 53.2 tp . . . . . 0 C--O 1.247 0.947 0 CA-C-N 119.83 1.815 . . . . 0.0 107.463 179.637 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 45.5 pt . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 116.956 -1.497 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -69.02 170.34 15.91 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 121.347 1.364 . . . . 0.0 109.055 178.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 28.5 m -156.31 165.43 36.38 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.36 141.47 42.45 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.186 0.994 . . . . 0.0 109.472 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -56.3 -31.24 83.89 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.692 2.261 . . . . 0.0 114.133 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.9 m -63.05 -36.67 76.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 119.363 0.983 . . . . 0.0 111.193 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -71.21 -44.62 65.03 Favored 'General case' 0 C--N 1.339 0.119 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.0 mt -57.75 -43.86 85.71 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.06 -51.5 69.37 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.083 0.953 . . . . 0.0 108.528 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.8 mtp180 -59.97 -34.51 73.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.168 0.894 . . . . 0.0 112.168 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 mt -72.06 -29.23 63.94 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.619 1.099 . . . . 0.0 109.65 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -36.07 21.38 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.008 -1.058 . . . . 0.0 110.255 178.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -64.84 -44.99 88.0 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.651 1.181 . . . . 0.0 108.787 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.34 -41.96 85.76 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 122.827 0.451 . . . . 0.0 109.971 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.19 -46.38 80.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.78 -44.75 96.38 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.76 -43.17 99.38 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.741 0.817 . . . . 0.0 110.321 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.5 tp -59.32 -46.5 88.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.01 -41.41 98.05 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.932 0.493 . . . . 0.0 110.146 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.92 -49.37 76.43 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 123.564 0.746 . . . . 0.0 109.409 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.5 mm -61.87 -40.36 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.91 -47.54 85.91 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.037 0.835 . . . . 0.0 109.246 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.86 -37.38 81.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.424 1.09 . . . . 0.0 110.081 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.11 -50.84 68.9 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.553 1.141 . . . . 0.0 108.12 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.5 mt -62.55 -29.5 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 123.696 0.798 . . . . 0.0 109.821 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.77 -17.23 55.19 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 118.831 0.741 . . . . 0.0 109.935 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.26 -35.52 10.78 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 109.938 -1.265 . . . . 0.0 109.938 178.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.87 91.41 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.3 mt -55.17 -23.59 22.43 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.419 1.088 . . . . 0.0 112.36 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.66 -26.5 67.82 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.494 1.043 . . . . 0.0 110.116 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.8 mt -86.52 -12.45 48.78 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.945 1.698 . . . . 0.0 110.068 178.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 121.32 -21.98 8.02 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 126.441 1.972 . . . . 0.0 113.239 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.3 tt . . . . . 0 C--O 1.247 0.953 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 179.315 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 46.2 pt . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 117.335 -1.316 . . . . 0.0 108.227 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -71.57 176.61 7.86 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.189 1.926 . . . . 0.0 108.758 178.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 52.31 67.71 0.93 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.751 1.22 . . . . 0.0 110.992 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.5 m -55.21 147.9 33.48 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 123.467 0.707 . . . . 0.0 110.151 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -56.17 -30.74 80.88 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.756 2.304 . . . . 0.0 113.488 -178.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.6 m -63.66 -33.28 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.45 -0.781 . . . . 0.0 109.943 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.413 ' CD2' ' HE ' ' A' ' 10' ' ' ARG . 4.6 m80 -72.47 -40.67 66.77 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 119.417 1.008 . . . . 0.0 108.581 178.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.83 -44.59 90.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -61.37 -47.3 86.47 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 124.224 1.01 . . . . 0.0 109.602 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.413 ' HE ' ' CD2' ' A' ' 7' ' ' HIS . 27.3 mtp85 -57.89 -34.83 70.22 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 119.68 1.127 . . . . 0.0 111.76 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 mp -71.26 -46.75 60.26 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 119.991 1.269 . . . . 0.0 107.666 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -34.23 77.63 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.986 -0.53 . . . . 0.0 111.253 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.0 tp -67.75 -44.47 77.46 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.053 0.941 . . . . 0.0 108.818 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.92 -45.66 91.88 Favored 'General case' 0 C--O 1.226 -0.151 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.21 -48.11 83.03 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.124 0.57 . . . . 0.0 109.825 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.55 -44.64 93.19 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.36 0.664 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.9 tt -60.6 -43.43 97.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.107 0.963 . . . . 0.0 110.549 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -58.8 -51.46 69.89 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.4 tt -59.96 -40.05 87.69 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.792 0.837 . . . . 0.0 110.633 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -63.6 -43.91 95.52 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.381 0.672 . . . . 0.0 110.117 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.51 -42.87 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.25 -48.8 80.27 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.28 -37.69 78.29 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.084 1.354 . . . . 0.0 110.664 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 tt -59.74 -52.04 67.18 Favored 'General case' 0 C--O 1.23 0.061 0 C-N-CA 124.727 1.211 . . . . 0.0 108.546 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 48.3 mm -65.19 -38.4 82.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 43.6 tp -65.08 -13.9 59.15 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.15 -44.49 5.94 Favored Glycine 0 C--N 1.341 0.814 0 N-CA-C 107.948 -2.061 . . . . 0.0 107.948 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.82 -36.48 76.88 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -26.69 63.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.508 1.523 . . . . 0.0 111.192 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 73.6 mt -69.09 -19.98 64.07 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.412 -0.805 . . . . 0.0 111.192 179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -104.58 -28.28 11.36 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.734 1.213 . . . . 0.0 109.757 179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.41 -22.82 33.36 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 126.845 2.164 . . . . 0.0 112.094 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.022 0 C-N-CA 128.154 2.582 . . . . 0.0 109.922 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.4 mp . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -74.05 72.3 4.05 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.518 2.812 . . . . 0.0 110.609 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.6 t -71.52 73.83 0.76 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.324 1.45 . . . . 0.0 108.698 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.3 m -63.08 153.17 82.11 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 124.751 1.22 . . . . 0.0 109.257 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.25 -25.9 58.49 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.05 2.5 . . . . 0.0 114.603 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -60.58 -30.53 46.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 119.311 0.96 . . . . 0.0 111.001 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -66.68 -50.11 63.93 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 79.0 mt -59.16 -41.84 89.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -60.86 -48.5 81.54 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.293 1.037 . . . . 0.0 109.9 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -62.2 -35.94 80.41 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 119.438 1.017 . . . . 0.0 110.962 179.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 69.1 mt -70.46 -44.81 67.01 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.487 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -64.23 -39.55 94.2 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.646 -0.692 . . . . 0.0 110.182 178.987 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.1 tp -63.1 -48.96 76.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.705 0.802 . . . . 0.0 109.258 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -57.91 -45.23 86.8 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.321 0.648 . . . . 0.0 109.908 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.7 mt -64.58 -42.58 95.53 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.77 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.02 -39.13 92.95 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.502 0.592 . . . . 0.0 109.905 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.2 tp -65.05 -44.12 90.05 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.1 tp -59.58 -45.58 91.45 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.3 -43.39 98.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.452 0.701 . . . . 0.0 109.813 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.47 -49.33 77.97 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-N 118.652 0.66 . . . . 0.0 109.571 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.0 mm -62.74 -39.43 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.0 tp -61.48 -47.91 83.5 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.161 0.891 . . . . 0.0 109.101 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.48 -40.08 85.83 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.977 1.311 . . . . 0.0 109.443 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -61.63 -51.19 69.49 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -62.12 -23.73 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 124.633 1.173 . . . . 0.0 110.912 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.75 -19.51 62.54 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.664 1.12 . . . . 0.0 109.485 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.07 -44.33 77.76 Favored Glycine 0 C--N 1.343 0.963 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.99 -42.54 80.61 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.9 tt -55.14 -43.14 73.91 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.898 0.879 . . . . 0.0 111.304 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 pp -79.89 -9.12 59.64 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.7 tt -99.59 -29.62 12.59 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.213 1.005 . . . . 0.0 110.77 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 100.26 0.56 55.83 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.453 1.501 . . . . 0.0 113.024 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 62.2 tp . . . . . 0 C--O 1.247 0.942 0 C-N-CA 126.322 1.849 . . . . 0.0 106.765 179.58 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 28.5 mm . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -64.94 169.92 11.09 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 121.834 1.689 . . . . 0.0 109.512 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.3 t -154.76 -147.98 0.23 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.7 p -47.28 154.37 0.82 Allowed Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 127.795 2.438 . . . . 0.0 112.991 -178.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.07 -29.71 87.91 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.952 2.434 . . . . 0.0 113.657 -178.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.4 t -68.65 -39.02 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.9 m80 -67.78 -38.31 83.2 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 119.092 0.86 . . . . 0.0 109.364 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.5 mt -58.48 -45.27 89.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -52.74 64.46 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.327 1.051 . . . . 0.0 108.851 177.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -55.27 -34.4 64.03 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.785 1.234 . . . . 0.0 112.577 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mp -73.27 -27.52 61.61 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 119.376 0.989 . . . . 0.0 109.86 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.45 -39.5 18.88 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 120.944 -1.097 . . . . 0.0 109.485 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.2 tp -60.74 -41.28 95.06 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 124.947 1.299 . . . . 0.0 108.614 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.82 -41.73 82.82 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.7 mt -71.7 -39.61 70.08 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.13 -37.44 80.06 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 tt -62.93 -48.85 77.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.233 1.013 . . . . 0.0 108.657 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.02 -43.45 86.75 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.4 tp -63.44 -38.24 90.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.066 0.546 . . . . 0.0 110.417 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.8 tp -63.88 -45.15 90.71 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 118.771 0.714 . . . . 0.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.1 mm -63.99 -40.98 91.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.32 -49.1 79.11 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.73 -41.43 86.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.787 1.235 . . . . 0.0 110.265 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.48 -52.09 67.1 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.688 1.195 . . . . 0.0 108.606 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.2 mt -63.24 -31.37 52.5 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.065 0 C-N-CA 123.303 0.641 . . . . 0.0 110.134 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.79 -16.74 59.35 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.016 0.826 . . . . 0.0 109.423 178.048 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.89 -51.44 5.1 Favored Glycine 0 C--N 1.34 0.775 0 N-CA-C 107.858 -2.097 . . . . 0.0 107.858 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.91 -34.32 77.19 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.153 0.581 . . . . 0.0 109.89 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.0 tt -55.35 -37.96 68.15 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.722 1.209 . . . . 0.0 111.017 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 83.3 mt -69.62 -12.26 61.5 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.226 0.61 . . . . 0.0 112.167 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.4 tp -108.04 -2.27 19.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.653 1.981 . . . . 0.0 110.556 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 122.42 -9.46 9.4 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 116.288 -2.396 . . . . 0.0 115.679 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.9 mp . . . . . 0 N--CA 1.481 1.082 1 C-N-CA 133.404 4.681 . . . . 0.0 109.414 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 35.7 mm . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -67.7 172.34 10.69 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 122.33 2.02 . . . . 0.0 109.901 179.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.9 t 52.56 23.93 2.83 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.46 1.104 . . . . 0.0 113.815 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.7 p -58.43 154.78 31.42 Favored Pre-proline 0 C--O 1.24 0.59 0 CA-C-N 118.853 0.751 . . . . 0.0 110.687 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -60.45 -25.21 79.99 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.828 1.686 . . . . 0.0 111.838 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.8 t -65.18 -43.74 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -65.34 -44.38 87.93 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.15 -44.22 87.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -59.66 -49.15 78.87 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 178.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.5 84.63 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.767 0.827 . . . . 0.0 112.223 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -74.56 -25.17 59.13 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.921 0.889 . . . . 0.0 110.965 -178.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -38.73 20.05 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 tp -62.88 -46.9 85.67 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.39 -42.76 87.82 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.241 0.616 . . . . 0.0 110.54 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 64.4 tp -64.85 -47.4 78.07 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.032 0.378 . . . . 0.0 110.49 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.21 -42.68 99.53 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.31 -42.98 99.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.285 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.6 tp -58.58 -47.37 84.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.5 tp -62.14 -42.16 98.97 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.642 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.15 -46.34 87.62 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.806 0.442 . . . . 0.0 110.284 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 22.3 mm -62.11 -43.1 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.85 -51.36 70.36 Favored 'General case' 0 N--CA 1.461 0.112 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.33 -43.37 83.3 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.355 1.062 . . . . 0.0 110.868 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.63 -46.05 87.46 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.082 0.553 . . . . 0.0 110.061 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.4 mt -64.44 -35.26 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.08 0 C-N-CA 123.182 0.593 . . . . 0.0 110.077 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.8 tt -61.94 -17.15 55.87 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.09 -34.6 36.99 Favored Glycine 0 C--N 1.341 0.832 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.71 -45.19 62.58 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.99 -30.41 69.11 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 122.883 0.473 . . . . 0.0 110.098 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.2 -19.82 64.85 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.301 1.041 . . . . 0.0 111.14 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.13 -2.1 21.29 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.72 2.008 . . . . 0.0 110.965 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.33 31.07 20.49 Favored Glycine 0 CA--C 1.529 0.96 0 CA-C-O 118.41 -1.217 . . . . 0.0 113.682 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 116.635 -1.65 . . . . 0.0 107.335 179.652 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.2 mp . . . . . 0 N--CA 1.477 0.878 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -67.23 171.58 11.3 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.234 1.956 . . . . 0.0 111.231 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.4 m -158.76 155.83 28.68 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.751 1.62 . . . . 0.0 106.894 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.3 p -65.26 154.6 86.96 Favored Pre-proline 0 C--O 1.242 0.662 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.35 -25.8 76.59 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 121.478 1.452 . . . . 0.0 110.569 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.7 t -64.59 -48.37 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 123.931 0.892 . . . . 0.0 108.837 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -65.75 -38.18 88.38 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.485 1.038 . . . . 0.0 109.147 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.39 -43.8 98.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -62.77 -47.59 82.84 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.55 1.14 . . . . 0.0 108.292 178.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.3 tpm_? -56.63 -39.32 73.46 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.865 1.666 . . . . 0.0 111.266 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.76 -46.37 58.64 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -38.55 86.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.269 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.5 tp -66.4 -43.65 85.23 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.666 1.186 . . . . 0.0 109.402 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.56 -46.52 89.87 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.9 mt -63.84 -40.12 95.82 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.529 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.0 -46.75 87.85 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.428 0.558 . . . . 0.0 109.856 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.32 -42.44 98.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.193 0.452 . . . . 0.0 110.338 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -60.16 -47.01 87.72 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 tt -60.82 -41.09 95.07 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 123.841 0.856 . . . . 0.0 110.41 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.16 -49.18 76.88 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 118.481 0.582 . . . . 0.0 109.868 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.0 mm -64.11 -38.48 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.98 -49.44 77.43 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.09 -39.79 83.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.902 1.281 . . . . 0.0 109.933 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -61.26 -53.46 56.52 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.9 mt -63.36 -30.41 49.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 123.817 0.847 . . . . 0.0 110.935 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 51.7 tp -62.44 -15.91 52.19 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.067 0.849 . . . . 0.0 109.557 178.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.2 -37.68 87.02 Favored Glycine 0 C--N 1.341 0.814 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -31.64 71.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.859 0.829 . . . . 0.0 110.146 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -11.81 43.52 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.156 -0.965 . . . . 0.0 111.564 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.7 mt -99.01 -9.26 24.18 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.546 1.138 . . . . 0.0 111.669 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -120.32 -28.14 5.09 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.617 1.167 . . . . 0.0 112.069 -179.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.17 0.44 58.47 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 125.309 1.433 . . . . 0.0 111.354 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 pp . . . . . 0 C--O 1.253 1.26 0 C-N-CA 129.045 2.938 . . . . 0.0 106.329 179.563 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo . . . . . 0 N--CA 1.46 -0.442 0 CA-C-O 119.739 -0.192 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.53 -35.18 68.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.524 -0.735 . . . . 0.0 109.468 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -64.31 -50.04 69.42 Favored 'General case' 0 C--N 1.342 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.96 -40.08 87.81 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -59.06 -50.93 72.18 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -34.84 78.67 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.434 1.015 . . . . 0.0 111.156 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.3 tp -69.45 -31.16 69.3 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 119.244 0.929 . . . . 0.0 109.633 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -35.4 22.81 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.153 -0.967 . . . . 0.0 109.973 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.89 -46.77 83.42 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -58.08 -44.35 87.52 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.334 0.654 . . . . 0.0 109.916 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 tp -63.77 -44.32 93.75 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.4 -42.09 99.16 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.88 -44.5 95.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.337 0.655 . . . . 0.0 109.679 179.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.5 tt -57.82 -50.06 74.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.9 tp -60.61 -38.77 85.79 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.535 0.734 . . . . 0.0 111.078 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.58 -48.9 75.5 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.8 mt -61.37 -41.09 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.8 tt -59.35 -51.11 71.34 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.09 -39.93 83.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.809 1.244 . . . . 0.0 110.468 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -59.42 -52.09 67.08 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.413 1.085 . . . . 0.0 108.404 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 77.7 mt . . . . . 0 C--N 1.335 -0.064 0 C-N-CA 123.034 0.534 . . . . 0.0 109.912 179.783 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo . . . . . 0 N--CA 1.462 -0.375 0 N-CA-C 113.504 0.54 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -62.75 -33.19 58.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.416 -0.802 . . . . 0.0 109.742 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -71.56 -40.53 69.92 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -59.74 -44.0 93.97 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -62.13 -47.58 83.95 Favored 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.778 1.231 . . . . 0.0 108.978 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -58.84 -36.41 74.51 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.144 1.378 . . . . 0.0 111.372 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -73.4 -48.18 35.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.47 -36.13 79.56 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.663 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.67 -44.26 86.79 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.94 -45.22 93.31 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -58.9 -50.38 74.24 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.873 0.869 . . . . 0.0 109.674 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.1 -45.03 83.74 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.761 0.825 . . . . 0.0 110.023 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.1 mt -62.61 -43.26 99.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.5 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.42 -45.13 94.72 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 119.005 0.82 . . . . 0.0 108.983 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.6 -42.42 98.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.22 0.608 . . . . 0.0 110.059 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.55 -48.78 79.45 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 123.472 0.709 . . . . 0.0 109.422 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.73 -42.65 95.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 123.726 0.81 . . . . 0.0 109.191 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -59.41 -49.43 77.84 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 118.741 0.7 . . . . 0.0 109.529 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 61.8 tp -59.85 -39.75 86.25 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.322 1.049 . . . . 0.0 110.125 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.65 -52.13 66.43 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.651 1.18 . . . . 0.0 108.418 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.0 mt . . . . . 0 N--CA 1.46 0.071 0 C-N-CA 123.372 0.669 . . . . 0.0 109.865 179.691 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo . . . . . 0 N--CA 1.459 -0.502 0 CA-C-O 119.734 -0.194 . . . . 0.0 112.103 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.01 -31.98 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 O-C-N 121.429 -0.794 . . . . 0.0 110.44 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -71.16 -39.81 71.69 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.014 1.279 . . . . 0.0 107.862 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.79 -43.07 99.76 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -62.13 -46.79 87.43 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.86 1.264 . . . . 0.0 108.698 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -57.3 -36.78 71.49 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.006 1.722 . . . . 0.0 111.231 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.7 tp -72.64 -49.79 29.51 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -35.77 73.6 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 118.933 -0.556 . . . . 0.0 111.475 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.7 tp -67.77 -43.42 79.85 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.322 1.049 . . . . 0.0 109.255 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -61.67 -47.44 85.36 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.1 mt -63.29 -42.6 99.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.903 0.481 . . . . 0.0 110.229 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.63 -45.5 93.81 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.85 -42.56 99.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.696 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.5 -53.42 57.67 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.78 -44.18 94.03 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.774 0.83 . . . . 0.0 110.849 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.34 -49.64 76.8 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.204 0.602 . . . . 0.0 110.743 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.9 mm -64.47 -38.72 83.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.3 tp -60.69 -49.41 77.61 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.82 -41.96 92.43 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.997 1.319 . . . . 0.0 109.821 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 tt -59.29 -52.32 66.18 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 124.392 1.077 . . . . 0.0 108.622 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 89.5 mt . . . . . 0 CA--C 1.529 0.16 0 C-N-CA 123.601 0.76 . . . . 0.0 110.655 -179.842 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 N--CA 1.46 -0.499 0 CA-C-O 119.564 -0.265 . . . . 0.0 112.575 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.66 -29.68 47.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 121.363 -0.835 . . . . 0.0 110.791 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -69.8 -49.08 56.23 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.64 -42.76 84.07 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -60.82 -47.05 88.12 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.239 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 -58.57 -36.97 74.77 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 119.662 1.119 . . . . 0.0 111.657 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -71.61 -48.13 50.05 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.39 -33.22 75.06 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.642 -0.694 . . . . 0.0 111.913 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.0 tp -67.46 -48.81 66.12 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.28 -48.48 80.34 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.272 0.629 . . . . 0.0 109.308 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.4 tp -59.51 -46.69 88.12 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.568 0.747 . . . . 0.0 110.684 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.89 -44.89 95.88 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.11 0.414 . . . . 0.0 110.573 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.74 -43.72 95.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.208 0.458 . . . . 0.0 110.365 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.1 tp -59.88 -47.08 87.2 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.95 -41.13 95.71 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.644 0.778 . . . . 0.0 110.473 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.42 -50.67 70.57 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -61.67 -40.89 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.94 -52.2 66.77 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.02 -40.22 80.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.675 1.19 . . . . 0.0 110.556 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.44 -57.01 14.84 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.424 1.09 . . . . 0.0 108.879 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.8 mm . . . . . 0 CA--C 1.528 0.131 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.997 -179.748 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo . . . . . 0 N--CA 1.46 -0.486 0 CA-C-O 119.222 -0.407 . . . . 0.0 112.965 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.8 t -62.11 -44.6 99.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -41.06 97.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.11 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.89 -44.28 94.32 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.5 tptp -58.9 -51.24 70.89 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.384 1.074 . . . . 0.0 108.596 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -35.93 75.4 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 124.679 1.192 . . . . 0.0 111.605 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.7 mt -73.39 -27.17 61.32 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 119.057 0.844 . . . . 0.0 109.909 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -38.97 18.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.033 -1.042 . . . . 0.0 109.908 178.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.71 -47.57 85.69 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.554 1.542 . . . . 0.0 108.491 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -54.98 -41.19 70.87 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 122.79 0.436 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -71.32 -43.0 67.88 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.622 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.79 -41.96 96.61 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 118.164 0.438 . . . . 0.0 110.023 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tt -64.96 -45.45 85.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.591 1.156 . . . . 0.0 110.062 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.9 tp -60.51 -45.43 93.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.09 -39.66 93.22 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.404 0.681 . . . . 0.0 110.452 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.51 -48.01 81.43 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 118.861 0.755 . . . . 0.0 109.173 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.7 mt -60.68 -45.04 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -57.87 -50.96 71.54 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.778 0.831 . . . . 0.0 109.539 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.15 -42.06 85.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.747 1.219 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.55 -47.06 83.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.073 0.549 . . . . 0.0 109.693 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.5 mt . . . . . 0 N--CA 1.462 0.155 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.72 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 N--CA 1.46 -0.47 0 N-CA-C 113.512 0.543 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.8 m -63.15 -35.43 71.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 119.153 0.888 . . . . 0.0 110.96 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 -70.44 -46.78 63.22 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.52 -44.07 80.43 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.7 tptt -59.42 -51.8 68.33 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.799 0.84 . . . . 0.0 108.799 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -60.21 -34.75 74.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.137 0.881 . . . . 0.0 111.87 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mp -70.6 -28.27 64.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 119.529 1.058 . . . . 0.0 109.666 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -40.06 16.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.138 -0.976 . . . . 0.0 109.983 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.1 tp -60.8 -43.67 97.86 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.92 1.288 . . . . 0.0 108.837 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.69 -41.06 80.86 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.887 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.0 mt -69.62 -43.79 71.98 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.161 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.13 -43.5 95.64 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 118.076 0.398 . . . . 0.0 109.947 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 tp -65.2 -44.34 88.68 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.889 0.875 . . . . 0.0 110.3 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.2 tp -59.77 -45.17 93.07 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 tt -62.01 -42.21 98.91 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.374 0.67 . . . . 0.0 109.981 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 tp -62.3 -46.65 87.78 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.486 0.584 . . . . 0.0 109.893 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.9 mt -63.9 -41.57 92.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.06 -49.52 77.57 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.931 0.787 . . . . 0.0 109.086 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.88 -42.39 84.5 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.894 1.278 . . . . 0.0 109.814 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -59.48 -55.44 34.59 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.741 1.216 . . . . 0.0 108.774 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 47.1 mm . . . . . 0 CA--C 1.532 0.267 0 C-N-CA 123.645 0.778 . . . . 0.0 110.967 -179.961 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo . . . . . 0 N--CA 1.462 -0.345 0 N-CA-C 114.99 1.112 . . . . 0.0 114.99 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 37.3 t -61.66 -34.33 61.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 119.416 1.007 . . . . 0.0 109.289 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -66.85 -46.5 74.85 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.07 -42.19 89.8 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -61.52 -47.52 85.22 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.28 68.65 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 119.616 1.098 . . . . 0.0 112.244 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 tt -70.89 -51.29 27.13 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -34.68 76.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.557 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.2 tp -66.35 -44.9 81.94 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 124.238 1.015 . . . . 0.0 108.886 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.57 -45.91 90.46 Favored 'General case' 0 C--O 1.227 -0.123 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.94 -43.79 98.12 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.52 -38.07 88.52 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 119.043 -0.504 . . . . 0.0 110.325 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -64.32 -47.84 77.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.1 mt -58.11 -44.67 87.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.2 tp -62.26 -39.52 93.14 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.105 0.562 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.2 -46.45 83.85 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.801 0.728 . . . . 0.0 109.62 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.2 mm -63.93 -40.48 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.8 tp -59.71 -49.69 76.75 Favored 'General case' 0 C--O 1.226 -0.132 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 tt -58.64 -39.52 80.77 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.925 1.29 . . . . 0.0 110.402 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.1 tt -59.5 -54.11 50.36 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.341 1.056 . . . . 0.0 108.459 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 CA--C 1.528 0.127 0 CA-C-O 119.512 -0.28 . . . . 0.0 110.55 179.821 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo . . . . . 0 CA--C 1.534 0.477 0 N-CA-C 115.719 1.392 . . . . 0.0 115.719 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.42 -31.25 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 118.981 0.81 . . . . 0.0 110.621 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -69.82 -48.89 57.35 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.3 mp -55.1 -44.71 75.16 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.95 -53.74 53.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.8 mtt-85 -59.66 -33.75 71.94 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.293 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.36 -25.23 61.44 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 120.074 1.306 . . . . 0.0 109.708 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -40.33 17.77 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.019 -1.051 . . . . 0.0 108.875 177.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.4 tp -65.92 -52.28 51.31 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.799 0.84 . . . . 0.0 109.875 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.74 -44.33 90.46 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 123.175 0.59 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.32 -33.17 71.19 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.573 -0.851 . . . . 0.0 111.346 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.6 tp -67.51 -42.86 82.16 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.78 -45.75 91.2 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.036 0.934 . . . . 0.0 109.099 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.1 tp -60.14 -43.66 95.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.21 -38.63 89.88 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.129 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.37 -43.99 92.79 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.102 0.864 . . . . 0.0 109.146 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.68 -45.52 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.14 -46.89 82.32 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.651 0.78 . . . . 0.0 110.349 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -56.36 -43.94 79.63 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.903 1.281 . . . . 0.0 110.158 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.96 -47.27 72.15 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 CA--C 1.532 0.261 0 C-N-CA 125.0 1.32 . . . . 0.0 110.873 179.409 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 CA--C 1.533 0.461 0 N-CA-C 110.167 -0.744 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.0 m -65.04 -32.84 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 O-C-N 121.808 -0.557 . . . . 0.0 109.772 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -70.42 -41.81 72.42 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.304 0.956 . . . . 0.0 108.986 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.6 mt -60.16 -41.15 92.19 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -61.68 -51.75 67.13 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.974 0.909 . . . . 0.0 108.554 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 -58.85 -36.79 75.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.498 1.519 . . . . 0.0 111.682 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.12 -39.4 72.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -42.5 90.22 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.31 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 tt -62.17 -55.38 29.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 124.025 0.93 . . . . 0.0 108.75 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -55.8 -44.95 78.28 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 123.918 0.887 . . . . 0.0 111.353 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.9 mt -68.45 -37.85 80.58 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.512 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.4 mt -66.78 -42.19 86.43 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.5 tp -63.72 -44.04 94.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.217 0.607 . . . . 0.0 109.705 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.04 -46.43 88.25 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 tp -62.03 -40.93 97.38 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 119.057 -0.497 . . . . 0.0 110.378 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 tt -62.31 -49.26 76.35 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 30.0 mm -60.49 -43.96 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 tt -58.69 -50.62 73.22 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.592 0.757 . . . . 0.0 109.345 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.35 -42.36 86.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 124.529 1.132 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.2 -46.89 81.93 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.315 0.646 . . . . 0.0 109.717 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.9 mt . . . . . 0 N--CA 1.46 0.06 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.977 179.788 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo . . . . . 0 CA--C 1.531 0.367 0 N-CA-C 111.251 -0.327 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.5 -32.88 60.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.631 -0.668 . . . . 0.0 111.018 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -71.97 -41.0 68.23 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.833 1.197 . . . . 0.0 108.831 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 75.4 mt -61.21 -41.47 96.9 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 177.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.9 tptp -62.27 -49.12 76.95 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.604 1.161 . . . . 0.0 109.434 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -60.14 -35.76 76.01 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.436 1.095 . . . . 0.0 110.84 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.5 mt -70.44 -45.7 65.3 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.23 -35.6 81.34 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.781 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -66.4 -45.78 78.83 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.29 -46.63 88.03 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.655 0.782 . . . . 0.0 109.263 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.33 -40.7 97.22 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.062 -0.494 . . . . 0.0 110.353 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.3 tt -63.4 -45.53 90.59 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.8 -43.44 98.79 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.019 0.528 . . . . 0.0 109.957 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.6 tp -60.27 -44.37 95.39 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.7 tt -62.2 -41.37 98.3 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 123.316 0.647 . . . . 0.0 109.796 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.0 tt -63.11 -43.84 97.32 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.65 0.659 . . . . 0.0 109.775 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.7 mt -63.75 -44.8 98.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.15 -48.97 79.65 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.655 0.782 . . . . 0.0 109.245 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.1 tt -55.65 -43.99 76.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.193 1.397 . . . . 0.0 111.089 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 19.2 mt -64.94 -45.12 87.09 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 123.694 0.798 . . . . 0.0 109.358 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.0 mt . . . . . 0 N--CA 1.462 0.136 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.466 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo . . . . . 0 CA--C 1.533 0.434 0 N-CA-C 111.136 -0.371 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -63.4 -27.74 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.51 0.724 . . . . 0.0 110.842 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -69.81 -51.16 36.03 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.92 -41.97 79.13 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -62.86 -47.72 82.14 Favored 'General case' 0 C--N 1.341 0.239 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.78 -40.86 85.21 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.127 0.876 . . . . 0.0 111.701 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.75 -25.83 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 118.879 0.763 . . . . 0.0 110.471 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.8 -40.75 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.348 -0.834 . . . . 0.0 109.932 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.3 tp -64.1 -47.77 78.74 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.909 0.884 . . . . 0.0 109.197 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.6 -43.83 89.69 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.52 -43.45 97.11 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-O 119.093 -0.48 . . . . 0.0 110.348 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.53 -48.51 81.45 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 122.909 0.484 . . . . 0.0 109.727 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.91 -45.01 94.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 119.257 -0.402 . . . . 0.0 110.833 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.14 -46.93 84.79 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.91 -41.33 97.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.564 0.746 . . . . 0.0 110.507 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.1 -50.38 72.14 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.944 0.793 . . . . 0.0 109.948 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 mm -62.65 -43.76 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.48 -49.61 76.72 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 123.269 0.627 . . . . 0.0 109.968 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.3 tp -56.65 -43.12 80.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.335 1.454 . . . . 0.0 111.437 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.8 mt -63.63 -47.59 80.74 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.74 0.816 . . . . 0.0 109.079 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 42.6 mm . . . . . 0 CA--C 1.531 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.185 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo . . . . . 0 N--CA 1.46 -0.494 0 N-CA-C 112.936 0.321 . . . . 0.0 112.936 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -63.49 -31.14 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.36 -0.838 . . . . 0.0 110.538 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -69.22 -46.66 66.85 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.67 -41.91 91.68 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -61.93 -48.5 80.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 118.197 -0.906 . . . . 0.0 108.94 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtt180 -60.15 -30.45 69.32 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.664 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.77 -50.83 39.45 Favored 'General case' 0 C--O 1.226 -0.183 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -36.36 82.34 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.41 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.25 -44.55 83.4 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -58.95 -45.28 90.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -63.05 -41.89 99.59 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.35 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 tt -61.94 -47.27 85.64 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.016 0.526 . . . . 0.0 109.656 179.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 80.5 mt -63.13 -42.11 99.43 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.342 0.657 . . . . 0.0 110.358 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.4 tp -60.62 -47.06 87.92 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -61.26 -40.72 95.13 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 123.475 0.71 . . . . 0.0 110.178 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.1 tt -61.56 -49.19 77.65 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.61 -42.1 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.84 -49.73 76.65 Favored 'General case' 0 C--O 1.226 -0.175 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.8 tp -60.69 -36.38 78.63 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.445 1.098 . . . . 0.0 110.504 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.53 -54.87 37.52 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 179.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.0 mm . . . . . 0 C--O 1.226 -0.155 0 CA-C-O 119.191 -0.433 . . . . 0.0 110.668 179.954 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo . . . . . 0 N--CA 1.461 -0.41 0 N-CA-C 114.0 0.731 . . . . 0.0 114.0 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.76 -35.39 67.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-N 119.145 0.884 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -67.36 -47.3 70.83 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 179.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -57.15 -43.73 82.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.2 -50.51 73.39 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 123.78 0.832 . . . . 0.0 108.865 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -40.35 78.02 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.823 1.249 . . . . 0.0 112.036 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.96 -26.8 61.49 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 124.235 1.014 . . . . 0.0 110.412 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.38 -38.39 20.34 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.247 -0.908 . . . . 0.0 109.453 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.5 tp -64.04 -45.79 87.27 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 124.223 1.009 . . . . 0.0 108.386 178.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.64 -44.76 93.39 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.5 tp -63.36 -43.72 96.85 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.506 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.32 -48.44 81.73 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.02 0.528 . . . . 0.0 109.703 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.2 tp -62.92 -43.16 99.55 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.759 0.424 . . . . 0.0 110.924 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -59.86 -47.24 86.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.3 tp -62.37 -39.71 94.07 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.203 0.601 . . . . 0.0 110.605 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.59 -48.49 79.21 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.574 0.625 . . . . 0.0 109.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.8 -41.04 91.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.8 tp -58.81 -50.39 74.14 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.05 -40.59 85.56 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 0.0 110.236 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -58.83 -56.3 24.02 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.538 1.135 . . . . 0.0 108.955 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.2 mm . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 119.098 -0.477 . . . . 0.0 110.685 -179.735 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo . . . . . 0 N--CA 1.462 -0.335 0 N-CA-C 113.859 0.676 . . . . 0.0 113.859 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.72 -29.8 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 121.4 -0.813 . . . . 0.0 110.114 178.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -69.85 -42.1 74.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.745 1.157 . . . . 0.0 108.311 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.92 -41.33 99.44 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -63.81 -47.54 80.42 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 124.649 1.18 . . . . 0.0 108.51 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -57.55 -35.27 70.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.628 1.971 . . . . 0.0 111.38 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -72.29 -48.86 39.12 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -36.94 81.76 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.924 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -64.97 -44.42 89.42 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 124.166 0.986 . . . . 0.0 108.427 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.86 -44.97 93.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.59 -49.35 75.58 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.889 0.476 . . . . 0.0 110.363 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.9 -38.41 88.26 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.545 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.8 tp -65.14 -43.74 90.91 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.744 0.702 . . . . 0.0 109.703 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -60.72 -45.87 92.58 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.1 tp -61.85 -40.5 95.57 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.034 0.534 . . . . 0.0 110.321 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.66 -47.22 84.63 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 77.8 mt -61.9 -41.98 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.44 -49.67 76.91 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 118.819 0.736 . . . . 0.0 109.337 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.75 -42.37 88.69 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.53 1.132 . . . . 0.0 110.118 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -58.87 -51.56 69.51 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 125.11 1.364 . . . . 0.0 108.637 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.9 mt . . . . . 0 C--N 1.335 -0.049 0 C-N-CA 123.175 0.59 . . . . 0.0 110.179 179.819 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo . . . . . 0 N--CA 1.458 -0.601 0 N-CA-C 114.133 0.782 . . . . 0.0 114.133 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.9 m -63.05 -36.67 76.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 119.363 0.983 . . . . 0.0 111.193 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -71.21 -44.62 65.03 Favored 'General case' 0 C--N 1.339 0.119 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.0 mt -57.75 -43.86 85.71 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.06 -51.5 69.37 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.083 0.953 . . . . 0.0 108.528 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.8 mtp180 -59.97 -34.51 73.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.168 0.894 . . . . 0.0 112.168 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 mt -72.06 -29.23 63.94 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.619 1.099 . . . . 0.0 109.65 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -36.07 21.38 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.008 -1.058 . . . . 0.0 110.255 178.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -64.84 -44.99 88.0 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.651 1.181 . . . . 0.0 108.787 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.34 -41.96 85.76 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 122.827 0.451 . . . . 0.0 109.971 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.19 -46.38 80.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.78 -44.75 96.38 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.76 -43.17 99.38 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.741 0.817 . . . . 0.0 110.321 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.5 tp -59.32 -46.5 88.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.01 -41.41 98.05 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.932 0.493 . . . . 0.0 110.146 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.92 -49.37 76.43 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 123.564 0.746 . . . . 0.0 109.409 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.5 mm -61.87 -40.36 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.91 -47.54 85.91 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.037 0.835 . . . . 0.0 109.246 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.86 -37.38 81.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.424 1.09 . . . . 0.0 110.081 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.11 -50.84 68.9 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.553 1.141 . . . . 0.0 108.12 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.5 mt . . . . . 0 CA--C 1.53 0.19 0 C-N-CA 123.696 0.798 . . . . 0.0 109.821 179.504 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo . . . . . 0 CA--C 1.531 0.369 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.6 m -63.66 -33.28 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.45 -0.781 . . . . 0.0 109.943 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.413 ' CD2' ' HE ' ' A' ' 10' ' ' ARG . 4.6 m80 -72.47 -40.67 66.77 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 119.417 1.008 . . . . 0.0 108.581 178.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.83 -44.59 90.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -61.37 -47.3 86.47 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 124.224 1.01 . . . . 0.0 109.602 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.413 ' HE ' ' CD2' ' A' ' 7' ' ' HIS . 27.3 mtp85 -57.89 -34.83 70.22 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 119.68 1.127 . . . . 0.0 111.76 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 mp -71.26 -46.75 60.26 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 119.991 1.269 . . . . 0.0 107.666 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -34.23 77.63 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.986 -0.53 . . . . 0.0 111.253 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.0 tp -67.75 -44.47 77.46 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.053 0.941 . . . . 0.0 108.818 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.92 -45.66 91.88 Favored 'General case' 0 C--O 1.226 -0.151 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.21 -48.11 83.03 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.124 0.57 . . . . 0.0 109.825 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.55 -44.64 93.19 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.36 0.664 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.9 tt -60.6 -43.43 97.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.107 0.963 . . . . 0.0 110.549 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -58.8 -51.46 69.89 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.4 tt -59.96 -40.05 87.69 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.792 0.837 . . . . 0.0 110.633 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -63.6 -43.91 95.52 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.381 0.672 . . . . 0.0 110.117 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.51 -42.87 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.25 -48.8 80.27 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.28 -37.69 78.29 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.084 1.354 . . . . 0.0 110.664 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 tt -59.74 -52.04 67.18 Favored 'General case' 0 C--O 1.23 0.061 0 C-N-CA 124.727 1.211 . . . . 0.0 108.546 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 48.3 mm . . . . . 0 C--O 1.231 0.12 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 179.599 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo . . . . . 0 N--CA 1.462 -0.378 0 N-CA-C 114.603 0.963 . . . . 0.0 114.603 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -60.58 -30.53 46.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 119.311 0.96 . . . . 0.0 111.001 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -66.68 -50.11 63.93 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 79.0 mt -59.16 -41.84 89.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -60.86 -48.5 81.54 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.293 1.037 . . . . 0.0 109.9 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -62.2 -35.94 80.41 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 119.438 1.017 . . . . 0.0 110.962 179.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 69.1 mt -70.46 -44.81 67.01 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.487 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -64.23 -39.55 94.2 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.646 -0.692 . . . . 0.0 110.182 178.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.1 tp -63.1 -48.96 76.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.705 0.802 . . . . 0.0 109.258 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -57.91 -45.23 86.8 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.321 0.648 . . . . 0.0 109.908 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.7 mt -64.58 -42.58 95.53 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.77 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.02 -39.13 92.95 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.502 0.592 . . . . 0.0 109.905 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.2 tp -65.05 -44.12 90.05 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.1 tp -59.58 -45.58 91.45 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.3 -43.39 98.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.452 0.701 . . . . 0.0 109.813 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.47 -49.33 77.97 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-N 118.652 0.66 . . . . 0.0 109.571 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.0 mm -62.74 -39.43 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.0 tp -61.48 -47.91 83.5 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.161 0.891 . . . . 0.0 109.101 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.48 -40.08 85.83 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.977 1.311 . . . . 0.0 109.443 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -61.63 -51.19 69.49 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt . . . . . 0 CA--C 1.531 0.244 0 C-N-CA 124.633 1.173 . . . . 0.0 110.912 179.643 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 N--CA 1.462 -0.381 0 N-CA-C 113.657 0.599 . . . . 0.0 113.657 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.4 t -68.65 -39.02 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.9 m80 -67.78 -38.31 83.2 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 119.092 0.86 . . . . 0.0 109.364 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.5 mt -58.48 -45.27 89.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -52.74 64.46 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.327 1.051 . . . . 0.0 108.851 177.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -55.27 -34.4 64.03 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.785 1.234 . . . . 0.0 112.577 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mp -73.27 -27.52 61.61 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 119.376 0.989 . . . . 0.0 109.86 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.45 -39.5 18.88 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 120.944 -1.097 . . . . 0.0 109.485 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.2 tp -60.74 -41.28 95.06 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 124.947 1.299 . . . . 0.0 108.614 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.82 -41.73 82.82 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.7 mt -71.7 -39.61 70.08 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.13 -37.44 80.06 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 tt -62.93 -48.85 77.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.233 1.013 . . . . 0.0 108.657 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.02 -43.45 86.75 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.4 tp -63.44 -38.24 90.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.066 0.546 . . . . 0.0 110.417 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.8 tp -63.88 -45.15 90.71 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 118.771 0.714 . . . . 0.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.1 mm -63.99 -40.98 91.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.32 -49.1 79.11 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.73 -41.43 86.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.787 1.235 . . . . 0.0 110.265 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.48 -52.09 67.1 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.688 1.195 . . . . 0.0 108.606 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.2 mt . . . . . 0 C--O 1.228 -0.065 0 C-N-CA 123.303 0.641 . . . . 0.0 110.134 179.724 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo . . . . . 0 N--CA 1.456 -0.696 0 CA-C-O 119.091 -0.462 . . . . 0.0 111.838 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.8 t -65.18 -43.74 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -65.34 -44.38 87.93 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.15 -44.22 87.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -59.66 -49.15 78.87 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 178.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.5 84.63 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.767 0.827 . . . . 0.0 112.223 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -74.56 -25.17 59.13 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.921 0.889 . . . . 0.0 110.965 -178.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -38.73 20.05 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 tp -62.88 -46.9 85.67 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.39 -42.76 87.82 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.241 0.616 . . . . 0.0 110.54 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 64.4 tp -64.85 -47.4 78.07 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.032 0.378 . . . . 0.0 110.49 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.21 -42.68 99.53 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.31 -42.98 99.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.285 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.6 tp -58.58 -47.37 84.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.5 tp -62.14 -42.16 98.97 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.642 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.15 -46.34 87.62 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.806 0.442 . . . . 0.0 110.284 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 22.3 mm -62.11 -43.1 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.85 -51.36 70.36 Favored 'General case' 0 N--CA 1.461 0.112 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.33 -43.37 83.3 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.355 1.062 . . . . 0.0 110.868 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.63 -46.05 87.46 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.082 0.553 . . . . 0.0 110.061 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.4 mt . . . . . 0 N--CA 1.461 0.08 0 C-N-CA 123.182 0.593 . . . . 0.0 110.077 179.73 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo . . . . . 0 N--CA 1.454 -0.83 0 N-CA-C 110.569 -0.589 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.7 t -64.59 -48.37 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 123.931 0.892 . . . . 0.0 108.837 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -65.75 -38.18 88.38 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.485 1.038 . . . . 0.0 109.147 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.39 -43.8 98.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -62.77 -47.59 82.84 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.55 1.14 . . . . 0.0 108.292 178.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.3 tpm_? -56.63 -39.32 73.46 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.865 1.666 . . . . 0.0 111.266 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.76 -46.37 58.64 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -38.55 86.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.269 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.5 tp -66.4 -43.65 85.23 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.666 1.186 . . . . 0.0 109.402 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.56 -46.52 89.87 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.9 mt -63.84 -40.12 95.82 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.529 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.0 -46.75 87.85 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.428 0.558 . . . . 0.0 109.856 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.32 -42.44 98.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.193 0.452 . . . . 0.0 110.338 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -60.16 -47.01 87.72 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 tt -60.82 -41.09 95.07 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 123.841 0.856 . . . . 0.0 110.41 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.16 -49.18 76.88 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 118.481 0.582 . . . . 0.0 109.868 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.0 mm -64.11 -38.48 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.98 -49.44 77.43 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.09 -39.79 83.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.902 1.281 . . . . 0.0 109.933 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -61.26 -53.46 56.52 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.53 0.177 0 C-N-CA 123.817 0.847 . . . . 0.0 110.935 -179.598 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.8 tt . . . . . 0 N--CA 1.474 0.727 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -68.33 168.79 18.48 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 CA-C-N 120.857 1.342 . . . . 0.0 109.513 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 p -134.09 119.6 19.12 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -54.82 141.46 57.48 Favored Pre-proline 0 CA--C 1.539 0.521 0 C-N-CA 123.171 0.588 . . . . 0.0 110.046 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -61.12 -24.28 78.96 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.301 2.001 . . . . 0.0 112.543 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.53 -35.18 68.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.524 -0.735 . . . . 0.0 109.468 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -64.31 -50.04 69.42 Favored 'General case' 0 C--N 1.342 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.96 -40.08 87.81 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -59.06 -50.93 72.18 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -34.84 78.67 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.434 1.015 . . . . 0.0 111.156 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.3 tp -69.45 -31.16 69.3 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 119.244 0.929 . . . . 0.0 109.633 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -35.4 22.81 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.153 -0.967 . . . . 0.0 109.973 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.89 -46.77 83.42 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -58.08 -44.35 87.52 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 123.334 0.654 . . . . 0.0 109.916 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 tp -63.77 -44.32 93.75 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.4 -42.09 99.16 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.88 -44.5 95.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.337 0.655 . . . . 0.0 109.679 179.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.5 tt -57.82 -50.06 74.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.9 tp -60.61 -38.77 85.79 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.535 0.734 . . . . 0.0 111.078 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.58 -48.9 75.5 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 82.8 mt -61.37 -41.09 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.8 tt -59.35 -51.11 71.34 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.09 -39.93 83.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.809 1.244 . . . . 0.0 110.468 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -59.42 -52.09 67.08 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.413 1.085 . . . . 0.0 108.404 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 77.7 mt -64.72 -35.44 74.93 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.064 0 C-N-CA 123.034 0.534 . . . . 0.0 109.912 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.1 tp -64.77 -14.24 58.21 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.848 0.749 . . . . 0.0 109.304 177.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.89 -47.13 5.43 Favored Glycine 0 C--N 1.34 0.766 0 N-CA-C 107.307 -2.317 . . . . 0.0 107.307 178.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.57 74.24 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.123 0.969 . . . . 0.0 109.106 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.78 -29.17 62.38 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.925 1.29 . . . . 0.0 110.662 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.7 mt -69.83 -24.44 63.45 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.59 -0.694 . . . . 0.0 111.005 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.9 mt -89.78 -29.14 18.87 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 125.208 1.403 . . . . 0.0 109.094 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 107.42 -3.76 34.87 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 125.863 1.697 . . . . 0.0 113.027 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.2 tp . . . . . 0 C--O 1.25 1.12 0 CA-C-O 116.264 -1.827 . . . . 0.0 106.215 179.632 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 70.9 mt . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 105.11 -2.181 . . . . 0.0 105.11 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -75.54 45.99 1.55 Allowed 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.889 3.059 . . . . 0.0 111.868 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.2 m -61.63 -39.34 90.97 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.118 1.367 . . . . 0.0 113.887 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -59.92 135.18 90.09 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.145 0.578 . . . . 0.0 109.84 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -58.45 -25.49 73.94 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.706 2.271 . . . . 0.0 113.504 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -62.75 -33.19 58.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.416 -0.802 . . . . 0.0 109.742 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -71.56 -40.53 69.92 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -59.74 -44.0 93.97 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.8 tptp -62.13 -47.58 83.95 Favored 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.778 1.231 . . . . 0.0 108.978 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -58.84 -36.41 74.51 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.144 1.378 . . . . 0.0 111.372 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -73.4 -48.18 35.98 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.47 -36.13 79.56 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.663 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.8 tp -65.67 -44.26 86.79 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.94 -45.22 93.31 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -58.9 -50.38 74.24 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 123.873 0.869 . . . . 0.0 109.674 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.1 -45.03 83.74 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.761 0.825 . . . . 0.0 110.023 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.1 mt -62.61 -43.26 99.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.446 -0.788 . . . . 0.0 110.5 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.42 -45.13 94.72 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 119.005 0.82 . . . . 0.0 108.983 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.6 -42.42 98.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.22 0.608 . . . . 0.0 110.059 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.55 -48.78 79.45 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 123.472 0.709 . . . . 0.0 109.422 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.73 -42.65 95.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 123.726 0.81 . . . . 0.0 109.191 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -59.41 -49.43 77.84 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 118.741 0.7 . . . . 0.0 109.529 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 61.8 tp -59.85 -39.75 86.25 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.322 1.049 . . . . 0.0 110.125 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.65 -52.13 66.43 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.651 1.18 . . . . 0.0 108.418 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.0 mt -62.56 -32.59 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.071 0 C-N-CA 123.372 0.669 . . . . 0.0 109.865 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -14.77 51.18 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.969 0.804 . . . . 0.0 110.227 178.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.86 -38.92 10.86 Favored Glycine 0 C--N 1.34 0.792 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.4 -45.04 66.75 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 52.0 tp -59.57 -27.31 66.14 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.605 1.162 . . . . 0.0 110.939 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.88 -31.07 72.13 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.522 1.129 . . . . 0.0 110.088 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.9 tp -93.65 -29.2 15.57 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.04 1.336 . . . . 0.0 109.728 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 108.39 50.45 0.76 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.332 1.444 . . . . 0.0 111.346 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.0 tt . . . . . 0 C--O 1.246 0.872 0 C-N-CA 125.955 1.702 . . . . 0.0 107.113 179.487 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 25.6 pt . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 117.478 -1.248 . . . . 0.0 107.778 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -76.99 72.83 5.68 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.399 2.732 . . . . 0.0 111.324 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.3 p -152.68 129.21 10.71 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -58.89 141.95 85.14 Favored Pre-proline 0 C--O 1.239 0.511 0 C-N-CA 123.713 0.805 . . . . 0.0 110.961 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -61.67 -26.34 79.99 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.473 2.115 . . . . 0.0 112.103 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.01 -31.98 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 O-C-N 121.429 -0.794 . . . . 0.0 110.44 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -71.16 -39.81 71.69 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 120.014 1.279 . . . . 0.0 107.862 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.79 -43.07 99.76 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -62.13 -46.79 87.43 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.86 1.264 . . . . 0.0 108.698 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -57.3 -36.78 71.49 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.006 1.722 . . . . 0.0 111.231 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.7 tp -72.64 -49.79 29.51 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -35.77 73.6 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 118.933 -0.556 . . . . 0.0 111.475 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.7 tp -67.77 -43.42 79.85 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 124.322 1.049 . . . . 0.0 109.255 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -61.67 -47.44 85.36 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.1 mt -63.29 -42.6 99.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.903 0.481 . . . . 0.0 110.229 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 tt -60.63 -45.5 93.81 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.85 -42.56 99.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.696 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.5 tt -56.5 -53.42 57.67 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.78 -44.18 94.03 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.774 0.83 . . . . 0.0 110.849 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.34 -49.64 76.8 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 123.204 0.602 . . . . 0.0 110.743 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 36.9 mm -64.47 -38.72 83.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.3 tp -60.69 -49.41 77.61 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.82 -41.96 92.43 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.997 1.319 . . . . 0.0 109.821 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 tt -59.29 -52.32 66.18 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 124.392 1.077 . . . . 0.0 108.622 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 89.5 mt -63.7 -30.63 50.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 123.601 0.76 . . . . 0.0 110.655 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.6 tt -63.92 -16.56 61.76 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.249 0.931 . . . . 0.0 108.842 177.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -67.5 -35.63 87.09 Favored Glycine 0 C--N 1.341 0.848 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.37 -48.04 79.56 Favored 'General case' 0 C--O 1.224 -0.244 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.26 -32.42 72.23 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.54 -0.725 . . . . 0.0 110.945 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -79.33 -14.15 59.18 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.061 1.744 . . . . 0.0 112.867 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 96.9 mt -115.75 -29.04 6.54 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.869 1.213 . . . . 0.0 112.989 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 114.82 -14.76 19.55 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 126.468 1.985 . . . . 0.0 112.068 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.252 1.209 0 C-N-CA 127.468 2.307 . . . . 0.0 105.476 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 36.5 mm . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -64.0 -36.87 46.53 Favored 'Trans proline' 0 CA--C 1.533 0.469 0 C-N-CA 122.146 1.897 . . . . 0.0 111.963 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.7 m 51.93 21.45 1.48 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.01 140.32 9.0 Favored Pre-proline 0 C--O 1.239 0.506 0 C-N-CA 125.443 1.497 . . . . 0.0 111.526 -179.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.07 -29.86 88.39 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.516 2.144 . . . . 0.0 112.575 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.8 m -63.66 -29.68 47.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 121.363 -0.835 . . . . 0.0 110.791 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -69.8 -49.08 56.23 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.64 -42.76 84.07 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -60.82 -47.05 88.12 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.739 -1.124 . . . . 0.0 109.239 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 -58.57 -36.97 74.77 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 119.662 1.119 . . . . 0.0 111.657 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -71.61 -48.13 50.05 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.39 -33.22 75.06 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.642 -0.694 . . . . 0.0 111.913 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.0 tp -67.46 -48.81 66.12 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.28 -48.48 80.34 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.272 0.629 . . . . 0.0 109.308 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.4 tp -59.51 -46.69 88.12 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.568 0.747 . . . . 0.0 110.684 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.89 -44.89 95.88 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.11 0.414 . . . . 0.0 110.573 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.74 -43.72 95.62 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 118.208 0.458 . . . . 0.0 110.365 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.1 tp -59.88 -47.08 87.2 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.95 -41.13 95.71 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.644 0.778 . . . . 0.0 110.473 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.42 -50.67 70.57 Favored 'General case' 0 C--N 1.338 0.1 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.8 mt -61.67 -40.89 88.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.94 -52.2 66.77 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.02 -40.22 80.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.675 1.19 . . . . 0.0 110.556 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.44 -57.01 14.84 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.424 1.09 . . . . 0.0 108.879 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.8 mm -65.4 -28.43 44.39 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.131 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.997 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 46.2 tp -64.36 -17.16 63.46 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.068 0.849 . . . . 0.0 109.061 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.9 -49.82 5.85 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.83 -41.29 82.0 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.929 0.892 . . . . 0.0 109.761 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 67.1 mt -62.36 -15.29 47.61 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.746 0.818 . . . . 0.0 112.688 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 93.4 mt -102.36 -4.97 24.72 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.711 1.205 . . . . 0.0 111.434 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.8 tt -117.02 -29.54 5.94 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.524 1.13 . . . . 0.0 111.714 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 102.7 -5.1 50.76 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 125.38 1.467 . . . . 0.0 112.99 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 C--O 1.252 1.236 0 C-N-CA 127.812 2.445 . . . . 0.0 105.715 179.412 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 79.5 mt . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -62.37 -46.63 11.68 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.24 1.96 . . . . 0.0 111.724 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 t 49.5 13.35 0.08 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.67 1.988 . . . . 0.0 116.227 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.94 138.0 55.15 Favored Pre-proline 0 CA--C 1.538 0.49 0 C-N-CA 125.108 1.363 . . . . 0.0 110.528 -179.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -56.55 -34.56 95.48 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.742 2.295 . . . . 0.0 112.965 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.8 t -62.11 -44.6 99.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -41.06 97.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.11 178.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.5 mt -59.89 -44.28 94.32 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.5 tptp -58.9 -51.24 70.89 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.384 1.074 . . . . 0.0 108.596 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -35.93 75.4 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 124.679 1.192 . . . . 0.0 111.605 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.7 mt -73.39 -27.17 61.32 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 119.057 0.844 . . . . 0.0 109.909 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -38.97 18.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.033 -1.042 . . . . 0.0 109.908 178.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.71 -47.57 85.69 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.554 1.542 . . . . 0.0 108.491 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -54.98 -41.19 70.87 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 122.79 0.436 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -71.32 -43.0 67.88 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.622 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.79 -41.96 96.61 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 118.164 0.438 . . . . 0.0 110.023 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tt -64.96 -45.45 85.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.591 1.156 . . . . 0.0 110.062 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.9 tp -60.51 -45.43 93.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.09 -39.66 93.22 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.404 0.681 . . . . 0.0 110.452 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.51 -48.01 81.43 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 118.861 0.755 . . . . 0.0 109.173 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 92.7 mt -60.68 -45.04 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 tt -57.87 -50.96 71.54 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.778 0.831 . . . . 0.0 109.539 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.15 -42.06 85.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.747 1.219 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.55 -47.06 83.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.073 0.549 . . . . 0.0 109.693 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.92 -32.78 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.8 tp -63.5 -16.49 60.86 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -80.86 -28.12 47.6 Favored Glycine 0 C--N 1.342 0.895 0 N-CA-C 109.938 -1.265 . . . . 0.0 109.938 178.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -73.11 -48.44 35.63 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.4 mt -58.86 -38.46 78.83 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 123.814 0.846 . . . . 0.0 109.83 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.5 tp -62.75 -21.98 66.22 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.593 1.557 . . . . 0.0 111.107 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mp -103.32 -7.3 21.19 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.061 1.745 . . . . 0.0 111.052 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 92.61 32.74 7.91 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-O 118.159 -1.356 . . . . 0.0 114.122 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.4 tt . . . . . 0 C--O 1.247 0.943 0 CA-C-N 119.19 1.495 . . . . 0.0 108.786 179.556 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.8 tt . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -69.16 168.5 20.58 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 121.278 1.319 . . . . 0.0 109.612 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.8 t -159.0 170.14 22.75 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.5 138.7 59.86 Favored Pre-proline 0 CA--C 1.539 0.555 0 C-N-CA 123.98 0.912 . . . . 0.0 109.724 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.88 -29.28 85.77 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.517 2.145 . . . . 0.0 113.512 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.8 m -63.15 -35.43 71.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 119.153 0.888 . . . . 0.0 110.96 179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 -70.44 -46.78 63.22 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.52 -44.07 80.43 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.7 tptt -59.42 -51.8 68.33 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.799 0.84 . . . . 0.0 108.799 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -60.21 -34.75 74.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.137 0.881 . . . . 0.0 111.87 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mp -70.6 -28.27 64.73 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 119.529 1.058 . . . . 0.0 109.666 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -40.06 16.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.138 -0.976 . . . . 0.0 109.983 178.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.1 tp -60.8 -43.67 97.86 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 124.92 1.288 . . . . 0.0 108.837 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.69 -41.06 80.86 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.887 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.0 mt -69.62 -43.79 71.98 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.161 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.13 -43.5 95.64 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 118.076 0.398 . . . . 0.0 109.947 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 tp -65.2 -44.34 88.68 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.889 0.875 . . . . 0.0 110.3 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.2 tp -59.77 -45.17 93.07 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 tt -62.01 -42.21 98.91 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 123.374 0.67 . . . . 0.0 109.981 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 tp -62.3 -46.65 87.78 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.486 0.584 . . . . 0.0 109.893 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 89.9 mt -63.9 -41.57 92.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.2 tp -59.06 -49.52 77.57 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-N 118.931 0.787 . . . . 0.0 109.086 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.88 -42.39 84.5 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.894 1.278 . . . . 0.0 109.814 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -59.48 -55.44 34.59 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.741 1.216 . . . . 0.0 108.774 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 47.1 mm -63.0 -23.96 34.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 123.645 0.778 . . . . 0.0 110.967 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.74 -17.95 63.55 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.372 0.987 . . . . 0.0 109.336 178.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.69 -37.56 76.82 Favored Glycine 0 C--N 1.341 0.85 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.06 -33.4 73.25 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 117.755 0.777 . . . . 0.0 109.704 179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.38 -15.36 57.26 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.074 0.95 . . . . 0.0 111.547 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 68.9 mt -102.26 -6.44 23.13 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.856 1.262 . . . . 0.0 112.172 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.6 tt -121.38 -29.5 4.44 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.328 0.967 . . . . 0.0 112.763 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.4 -4.07 43.72 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.489 1.519 . . . . 0.0 112.332 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.3 tp . . . . . 0 C--O 1.246 0.901 0 C-N-CA 127.719 2.408 . . . . 0.0 106.138 179.514 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 44.0 mm . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -55.12 104.78 0.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 123.524 2.816 . . . . 0.0 110.272 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.0 t -167.79 -63.57 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 105.504 -2.036 . . . . 0.0 105.504 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.21 140.28 78.69 Favored Pre-proline 0 C--O 1.239 0.525 0 CA-C-O 117.732 -1.128 . . . . 0.0 108.8 -179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -54.33 -26.72 44.92 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.471 2.781 . . . . 0.0 114.99 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 37.3 t -61.66 -34.33 61.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 119.416 1.007 . . . . 0.0 109.289 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -66.85 -46.5 74.85 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.4 mp -59.07 -42.19 89.8 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.3 tptp -61.52 -47.52 85.22 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.28 68.65 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 119.616 1.098 . . . . 0.0 112.244 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 tt -70.89 -51.29 27.13 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.99 -34.68 76.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.557 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.2 tp -66.35 -44.9 81.94 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 124.238 1.015 . . . . 0.0 108.886 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.57 -45.91 90.46 Favored 'General case' 0 C--O 1.227 -0.123 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.94 -43.79 98.12 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.52 -38.07 88.52 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 119.043 -0.504 . . . . 0.0 110.325 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -64.32 -47.84 77.88 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.1 mt -58.11 -44.67 87.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.2 tp -62.26 -39.52 93.14 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.105 0.562 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.2 -46.45 83.85 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.801 0.728 . . . . 0.0 109.62 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 45.2 mm -63.93 -40.48 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.8 tp -59.71 -49.69 76.75 Favored 'General case' 0 C--O 1.226 -0.132 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 tt -58.64 -39.52 80.77 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.925 1.29 . . . . 0.0 110.402 179.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.1 tt -59.5 -54.11 50.36 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.341 1.056 . . . . 0.0 108.459 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.8 mm -65.11 -32.29 57.61 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 CA-C-O 119.512 -0.28 . . . . 0.0 110.55 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 41.8 tp -65.89 -15.38 62.9 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.89 0.768 . . . . 0.0 108.963 177.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.72 -47.02 5.52 Favored Glycine 0 C--N 1.34 0.788 0 N-CA-C 107.391 -2.283 . . . . 0.0 107.391 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.45 -40.33 74.64 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.3 mp -58.86 -17.98 28.71 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.713 1.205 . . . . 0.0 113.201 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.5 mt -76.79 -23.65 52.85 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.596 1.089 . . . . 0.0 111.131 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -121.34 -15.35 8.12 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 124.21 1.004 . . . . 0.0 113.514 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.04 14.74 60.19 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.277 -1.291 . . . . 0.0 113.632 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.9 tp . . . . . 0 C--O 1.246 0.91 0 C-N-CA 125.704 1.602 . . . . 0.0 107.243 179.934 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 17.5 tt . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -74.54 62.85 5.51 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.697 2.932 . . . . 0.0 112.123 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.6 m -103.0 -14.7 16.36 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.86 150.46 77.1 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-N 119.487 1.039 . . . . 0.0 108.637 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -52.84 -30.67 48.43 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.571 2.847 . . . . 0.0 115.719 -178.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.42 -31.25 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 118.981 0.81 . . . . 0.0 110.621 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -69.82 -48.89 57.35 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.3 mp -55.1 -44.71 75.16 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -60.95 -53.74 53.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 40.8 mtt-85 -59.66 -33.75 71.94 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.293 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.36 -25.23 61.44 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 120.074 1.306 . . . . 0.0 109.708 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -40.33 17.77 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.019 -1.051 . . . . 0.0 108.875 177.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.4 tp -65.92 -52.28 51.31 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.799 0.84 . . . . 0.0 109.875 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.74 -44.33 90.46 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 123.175 0.59 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.32 -33.17 71.19 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.573 -0.851 . . . . 0.0 111.346 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 62.6 tp -67.51 -42.86 82.16 Favored 'General case' 0 C--O 1.225 -0.205 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.78 -45.75 91.2 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.036 0.934 . . . . 0.0 109.099 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.1 tp -60.14 -43.66 95.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.2 tp -62.21 -38.63 89.88 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.129 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.37 -43.99 92.79 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.102 0.864 . . . . 0.0 109.146 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.68 -45.52 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.14 -46.89 82.32 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.651 0.78 . . . . 0.0 110.349 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -56.36 -43.94 79.63 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.903 1.281 . . . . 0.0 110.158 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.96 -47.27 72.15 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 26.6 mm -61.23 -23.08 29.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 125.0 1.32 . . . . 0.0 110.873 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.64 -23.7 52.63 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.07 0.85 . . . . 0.0 109.021 178.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.82 -51.02 31.8 Favored Glycine 0 C--N 1.343 0.919 0 N-CA-C 108.549 -1.82 . . . . 0.0 108.549 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.53 97.13 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.311 0.645 . . . . 0.0 109.407 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.3 mt -60.38 -23.99 64.75 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 117.992 -1.004 . . . . 0.0 112.798 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 pp -102.41 -6.99 22.36 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.593 1.088 . . . . 0.0 111.924 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.7 tp -101.73 -29.43 11.9 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.167 1.387 . . . . 0.0 111.327 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.16 -1.62 59.22 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.189 1.376 . . . . 0.0 112.86 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 C--O 1.252 1.206 0 C-N-CA 127.226 2.21 . . . . 0.0 106.005 179.498 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 32.1 mm . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 106.086 -1.82 . . . . 0.0 106.086 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.57 175.88 8.89 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 122.493 2.129 . . . . 0.0 110.024 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.3 t -157.23 173.07 17.51 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.39 152.72 63.29 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-O 118.281 -0.866 . . . . 0.0 108.98 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.01 -43.43 42.9 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 121.716 1.611 . . . . 0.0 110.167 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.0 m -65.04 -32.84 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 O-C-N 121.808 -0.557 . . . . 0.0 109.772 178.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.4 m80 -70.42 -41.81 72.42 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.304 0.956 . . . . 0.0 108.986 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.6 mt -60.16 -41.15 92.19 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -61.68 -51.75 67.13 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.974 0.909 . . . . 0.0 108.554 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 -58.85 -36.79 75.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.498 1.519 . . . . 0.0 111.682 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 39.3 mt -71.12 -39.4 72.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -42.5 90.22 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.31 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 tt -62.17 -55.38 29.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 124.025 0.93 . . . . 0.0 108.75 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -55.8 -44.95 78.28 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 123.918 0.887 . . . . 0.0 111.353 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.9 mt -68.45 -37.85 80.58 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.512 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.4 mt -66.78 -42.19 86.43 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.5 tp -63.72 -44.04 94.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.217 0.607 . . . . 0.0 109.705 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.04 -46.43 88.25 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 69.0 tp -62.03 -40.93 97.38 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 119.057 -0.497 . . . . 0.0 110.378 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 tt -62.31 -49.26 76.35 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 30.0 mm -60.49 -43.96 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 tt -58.69 -50.62 73.22 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.592 0.757 . . . . 0.0 109.345 179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tt -58.35 -42.36 86.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 124.529 1.132 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.2 -46.89 81.93 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.315 0.646 . . . . 0.0 109.717 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.9 mt -64.98 -32.7 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.06 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.977 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 48.4 tp -63.18 -16.93 61.68 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.193 0.906 . . . . 0.0 109.262 177.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.27 -27.31 49.2 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.497 1.046 . . . . 0.0 110.696 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.19 -46.73 10.8 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 178.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 tp -54.64 -41.14 69.71 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 125.51 1.524 . . . . 0.0 112.067 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 pp -66.5 -8.03 23.74 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.01 -1.85 12.96 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.38 2.272 . . . . 0.0 110.073 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 79.79 34.37 31.19 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.138 -0.812 . . . . 0.0 111.745 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.2 mt . . . . . 0 C--O 1.248 1.019 0 C-N-CA 126.506 1.922 . . . . 0.0 109.175 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 23.3 pt . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 117.778 -1.106 . . . . 0.0 108.389 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.96 7.05 3.41 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 124.062 3.175 . . . . 0.0 114.369 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -60.91 -0.43 0.3 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.994 2.118 . . . . 0.0 116.596 -178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.11 145.91 88.98 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-N 120.85 1.659 . . . . 0.0 108.014 179.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -56.76 -47.2 24.62 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 121.967 1.778 . . . . 0.0 111.251 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.5 -32.88 60.17 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.631 -0.668 . . . . 0.0 111.018 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -71.97 -41.0 68.23 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 119.833 1.197 . . . . 0.0 108.831 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 75.4 mt -61.21 -41.47 96.9 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 177.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.9 tptp -62.27 -49.12 76.95 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.604 1.161 . . . . 0.0 109.434 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -60.14 -35.76 76.01 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.436 1.095 . . . . 0.0 110.84 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.5 mt -70.44 -45.7 65.3 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.23 -35.6 81.34 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.781 179.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -66.4 -45.78 78.83 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.0 tt -59.29 -46.63 88.03 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.655 0.782 . . . . 0.0 109.263 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.7 mt -62.33 -40.7 97.22 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.062 -0.494 . . . . 0.0 110.353 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.3 tt -63.4 -45.53 90.59 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.8 -43.44 98.79 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.019 0.528 . . . . 0.0 109.957 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.6 tp -60.27 -44.37 95.39 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.7 tt -62.2 -41.37 98.3 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 123.316 0.647 . . . . 0.0 109.796 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 8.0 tt -63.11 -43.84 97.32 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.65 0.659 . . . . 0.0 109.775 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 76.7 mt -63.75 -44.8 98.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.15 -48.97 79.65 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.655 0.782 . . . . 0.0 109.245 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.1 tt -55.65 -43.99 76.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.193 1.397 . . . . 0.0 111.089 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 19.2 mt -64.94 -45.12 87.09 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 123.694 0.798 . . . . 0.0 109.358 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.0 mt -65.5 -33.04 60.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.136 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 43.3 tp -66.09 -14.98 62.67 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 118.854 0.752 . . . . 0.0 108.98 177.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.2 -51.71 3.46 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 106.792 -2.523 . . . . 0.0 106.792 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.57 -38.08 68.89 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.201 1.0 . . . . 0.0 110.042 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.6 tt -58.12 -24.23 57.97 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 125.505 1.522 . . . . 0.0 112.064 179.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.7 mt -102.1 -4.9 25.16 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.442 1.497 . . . . 0.0 112.205 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.4 tp -112.58 -29.18 7.55 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.908 1.283 . . . . 0.0 112.297 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.95 5.51 68.07 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.587 1.089 . . . . 0.0 111.825 -178.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--O 1.247 0.951 0 C-N-CA 128.147 2.579 . . . . 0.0 104.641 179.715 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 44.9 pt . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 117.216 -1.373 . . . . 0.0 108.014 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -69.74 162.77 40.76 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 121.479 1.453 . . . . 0.0 109.585 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t -167.28 173.09 9.23 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 179.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.8 m -55.5 143.89 55.76 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 123.716 0.807 . . . . 0.0 110.067 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -59.85 -34.21 95.66 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 121.901 1.734 . . . . 0.0 111.136 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -63.4 -27.74 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.51 0.724 . . . . 0.0 110.842 178.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -69.81 -51.16 36.03 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.92 -41.97 79.13 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -62.86 -47.72 82.14 Favored 'General case' 0 C--N 1.341 0.239 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.78 -40.86 85.21 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.127 0.876 . . . . 0.0 111.701 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.75 -25.83 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 118.879 0.763 . . . . 0.0 110.471 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.8 -40.75 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.348 -0.834 . . . . 0.0 109.932 178.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.3 tp -64.1 -47.77 78.74 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 123.909 0.884 . . . . 0.0 109.197 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.6 -43.83 89.69 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.52 -43.45 97.11 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-O 119.093 -0.48 . . . . 0.0 110.348 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.53 -48.51 81.45 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 122.909 0.484 . . . . 0.0 109.727 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 62.1 tp -62.91 -45.01 94.5 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 119.257 -0.402 . . . . 0.0 110.833 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.14 -46.93 84.79 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tt -61.91 -41.33 97.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.564 0.746 . . . . 0.0 110.507 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.1 -50.38 72.14 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.944 0.793 . . . . 0.0 109.948 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.2 mm -62.65 -43.76 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.48 -49.61 76.72 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 123.269 0.627 . . . . 0.0 109.968 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.3 tp -56.65 -43.12 80.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.335 1.454 . . . . 0.0 111.437 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.8 mt -63.63 -47.59 80.74 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.74 0.816 . . . . 0.0 109.079 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 42.6 mm -65.44 -28.93 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.74 -16.28 63.63 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.066 0.848 . . . . 0.0 109.044 177.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.68 -52.83 3.22 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 106.932 -2.467 . . . . 0.0 106.932 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.71 -37.67 68.71 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.656 0.783 . . . . 0.0 110.397 179.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.3 tt -58.56 -23.74 59.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.291 1.437 . . . . 0.0 112.013 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 78.1 mt -102.25 -7.64 21.96 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.212 1.405 . . . . 0.0 112.415 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.4 mp -111.13 -27.98 8.49 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.758 1.223 . . . . 0.0 112.431 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.85 -5.08 79.22 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 125.282 1.42 . . . . 0.0 111.726 -178.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 C--O 1.246 0.884 0 C-N-CA 129.132 2.973 . . . . 0.0 104.344 179.361 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 46.6 pt . . . . . 0 N--CA 1.476 0.862 0 CA-C-O 117.24 -1.362 . . . . 0.0 108.08 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -69.98 170.59 16.47 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 121.525 1.483 . . . . 0.0 109.022 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.7 p -154.07 166.49 32.87 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.63 136.07 82.51 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 123.691 0.796 . . . . 0.0 110.175 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -60.13 -25.22 79.33 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.369 2.046 . . . . 0.0 112.936 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.7 m -63.49 -31.14 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.36 -0.838 . . . . 0.0 110.538 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -69.22 -46.66 66.85 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.67 -41.91 91.68 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -61.93 -48.5 80.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 118.197 -0.906 . . . . 0.0 108.94 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtt180 -60.15 -30.45 69.32 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.664 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.77 -50.83 39.45 Favored 'General case' 0 C--O 1.226 -0.183 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.53 -36.36 82.34 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.41 179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 63.1 tp -66.25 -44.55 83.4 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -58.95 -45.28 90.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -63.05 -41.89 99.59 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.35 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 tt -61.94 -47.27 85.64 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 123.016 0.526 . . . . 0.0 109.656 179.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 80.5 mt -63.13 -42.11 99.43 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.342 0.657 . . . . 0.0 110.358 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.4 tp -60.62 -47.06 87.92 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -61.26 -40.72 95.13 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 123.475 0.71 . . . . 0.0 110.178 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.1 tt -61.56 -49.19 77.65 Favored 'General case' 0 C--O 1.226 -0.133 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.61 -42.1 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.84 -49.73 76.65 Favored 'General case' 0 C--O 1.226 -0.175 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 63.8 tp -60.69 -36.38 78.63 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.445 1.098 . . . . 0.0 110.504 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.53 -54.87 37.52 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 179.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.0 mm -65.93 -30.17 49.17 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.155 0 CA-C-O 119.191 -0.433 . . . . 0.0 110.668 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.8 tt -62.09 -20.81 64.42 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.443 1.02 . . . . 0.0 108.754 177.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.71 -44.87 5.65 Favored Glycine 0 C--N 1.34 0.802 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.85 -41.37 86.83 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.037 0.935 . . . . 0.0 110.042 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.6 mt -60.54 -22.62 63.83 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 124.612 1.165 . . . . 0.0 112.157 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.9 mt -67.21 -23.06 65.69 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.44 1.018 . . . . 0.0 109.665 178.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 10.7 mp -106.91 -3.19 20.48 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.39 1.876 . . . . 0.0 109.987 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.06 24.93 39.07 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 118.612 -1.104 . . . . 0.0 113.087 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp . . . . . 0 C--O 1.25 1.12 0 C-N-CA 125.502 1.521 . . . . 0.0 109.254 179.61 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 32.5 mm . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -72.85 75.55 2.65 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 123.225 2.617 . . . . 0.0 110.305 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 p -149.64 -56.7 0.19 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.716 0.807 . . . . 0.0 109.929 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.98 133.91 87.29 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -55.59 -29.82 71.83 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.727 2.285 . . . . 0.0 114.0 -178.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.76 -35.39 67.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 CA-C-N 119.145 0.884 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -67.36 -47.3 70.83 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 179.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.8 mp -57.15 -43.73 82.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.2 -50.51 73.39 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 123.78 0.832 . . . . 0.0 108.865 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -40.35 78.02 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.823 1.249 . . . . 0.0 112.036 179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 mp -72.96 -26.8 61.49 Favored 'General case' 0 CA--C 1.519 -0.215 0 C-N-CA 124.235 1.014 . . . . 0.0 110.412 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.38 -38.39 20.34 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.247 -0.908 . . . . 0.0 109.453 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.5 tp -64.04 -45.79 87.27 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 124.223 1.009 . . . . 0.0 108.386 178.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -59.64 -44.76 93.39 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.5 tp -63.36 -43.72 96.85 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.506 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.32 -48.44 81.73 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.02 0.528 . . . . 0.0 109.703 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.2 tp -62.92 -43.16 99.55 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.759 0.424 . . . . 0.0 110.924 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -59.86 -47.24 86.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.3 tp -62.37 -39.71 94.07 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.203 0.601 . . . . 0.0 110.605 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.0 tp -62.59 -48.49 79.21 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.574 0.625 . . . . 0.0 109.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.8 -41.04 91.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.8 tp -58.81 -50.39 74.14 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.05 -40.59 85.56 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.704 1.202 . . . . 0.0 110.236 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -58.83 -56.3 24.02 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.538 1.135 . . . . 0.0 108.955 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.2 mm -64.26 -31.87 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.091 0 CA-C-O 119.098 -0.477 . . . . 0.0 110.685 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 40.3 tp -62.99 -15.66 57.05 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.213 0.915 . . . . 0.0 109.911 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.11 -37.43 18.54 Favored Glycine 0 C--N 1.339 0.745 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 178.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.81 -38.19 88.29 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -57.55 -21.25 37.28 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.766 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 84.5 mt -66.24 -28.82 69.02 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.977 1.262 . . . . 0.0 109.937 178.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tt -85.01 -13.34 50.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.57 1.548 . . . . 0.0 109.204 178.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 122.19 -22.92 7.41 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 127.345 2.403 . . . . 0.0 112.47 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.246 0.907 0 CA-C-N 119.597 1.699 . . . . 0.0 107.299 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.51 156.74 54.84 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 121.741 1.627 . . . . 0.0 108.821 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.7 p -131.23 -83.9 0.52 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.536 0.335 . . . . 0.0 111.875 -178.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -53.84 149.88 15.74 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 125.0 1.32 . . . . 0.0 111.247 -178.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -56.21 -27.41 65.92 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.177 2.585 . . . . 0.0 113.859 -178.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.4 m -61.72 -29.8 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 121.4 -0.813 . . . . 0.0 110.114 178.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -69.85 -42.1 74.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.745 1.157 . . . . 0.0 108.311 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.92 -41.33 99.44 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -63.81 -47.54 80.42 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 124.649 1.18 . . . . 0.0 108.51 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -57.55 -35.27 70.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.628 1.971 . . . . 0.0 111.38 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 mt -72.29 -48.86 39.12 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.44 -36.94 81.76 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.924 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -64.97 -44.42 89.42 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 124.166 0.986 . . . . 0.0 108.427 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.86 -44.97 93.85 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.59 -49.35 75.58 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.889 0.476 . . . . 0.0 110.363 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.9 -38.41 88.26 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.545 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.8 tp -65.14 -43.74 90.91 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 118.744 0.702 . . . . 0.0 109.703 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.5 tp -60.72 -45.87 92.58 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.1 tp -61.85 -40.5 95.57 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.034 0.534 . . . . 0.0 110.321 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.3 tt -62.66 -47.22 84.63 Favored 'General case' 0 C--O 1.225 -0.223 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 77.8 mt -61.9 -41.98 92.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.44 -49.67 76.91 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 118.819 0.736 . . . . 0.0 109.337 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.75 -42.37 88.69 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.53 1.132 . . . . 0.0 110.118 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -58.87 -51.56 69.51 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 125.11 1.364 . . . . 0.0 108.637 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.9 -33.01 58.03 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.049 0 C-N-CA 123.175 0.59 . . . . 0.0 110.179 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.32 -16.46 62.24 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.189 0.904 . . . . 0.0 109.59 177.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.59 -37.89 8.5 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 178.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.2 -50.89 51.26 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 178.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 73.6 mt -56.01 -22.04 24.77 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 125.345 1.458 . . . . 0.0 112.307 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.92 -34.37 75.95 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.389 1.076 . . . . 0.0 108.782 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -85.83 -11.47 53.31 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.239 1.416 . . . . 0.0 110.446 178.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 121.15 -15.34 9.41 Favored Glycine 0 CA--C 1.529 0.969 0 C-N-CA 126.093 1.806 . . . . 0.0 114.624 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 53.2 tp . . . . . 0 C--O 1.247 0.947 0 CA-C-N 119.83 1.815 . . . . 0.0 107.463 179.637 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 45.5 pt . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 116.956 -1.497 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -69.02 170.34 15.91 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 121.347 1.364 . . . . 0.0 109.055 178.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 28.5 m -156.31 165.43 36.38 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.36 141.47 42.45 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.186 0.994 . . . . 0.0 109.472 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -56.3 -31.24 83.89 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.692 2.261 . . . . 0.0 114.133 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.9 m -63.05 -36.67 76.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 119.363 0.983 . . . . 0.0 111.193 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -71.21 -44.62 65.03 Favored 'General case' 0 C--N 1.339 0.119 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.0 mt -57.75 -43.86 85.71 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -60.06 -51.5 69.37 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.083 0.953 . . . . 0.0 108.528 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.8 mtp180 -59.97 -34.51 73.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.168 0.894 . . . . 0.0 112.168 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 mt -72.06 -29.23 63.94 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.619 1.099 . . . . 0.0 109.65 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -36.07 21.38 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.008 -1.058 . . . . 0.0 110.255 178.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.6 tp -64.84 -44.99 88.0 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.651 1.181 . . . . 0.0 108.787 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.34 -41.96 85.76 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 122.827 0.451 . . . . 0.0 109.971 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.19 -46.38 80.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.78 -44.75 96.38 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.3 tp -61.76 -43.17 99.38 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.741 0.817 . . . . 0.0 110.321 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.5 tp -59.32 -46.5 88.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.01 -41.41 98.05 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.932 0.493 . . . . 0.0 110.146 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.92 -49.37 76.43 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 123.564 0.746 . . . . 0.0 109.409 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 34.5 mm -61.87 -40.36 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.91 -47.54 85.91 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.037 0.835 . . . . 0.0 109.246 178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.86 -37.38 81.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.424 1.09 . . . . 0.0 110.081 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.11 -50.84 68.9 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.553 1.141 . . . . 0.0 108.12 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.5 mt -62.55 -29.5 47.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 123.696 0.798 . . . . 0.0 109.821 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.77 -17.23 55.19 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 118.831 0.741 . . . . 0.0 109.935 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.26 -35.52 10.78 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 109.938 -1.265 . . . . 0.0 109.938 178.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.87 91.41 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.3 mt -55.17 -23.59 22.43 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.419 1.088 . . . . 0.0 112.36 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.66 -26.5 67.82 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.494 1.043 . . . . 0.0 110.116 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.8 mt -86.52 -12.45 48.78 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.945 1.698 . . . . 0.0 110.068 178.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 121.32 -21.98 8.02 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 126.441 1.972 . . . . 0.0 113.239 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.3 tt . . . . . 0 C--O 1.247 0.953 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 179.315 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 46.2 pt . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 117.335 -1.316 . . . . 0.0 108.227 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -71.57 176.61 7.86 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.189 1.926 . . . . 0.0 108.758 178.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 52.31 67.71 0.93 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.751 1.22 . . . . 0.0 110.992 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.5 m -55.21 147.9 33.48 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 123.467 0.707 . . . . 0.0 110.151 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -56.17 -30.74 80.88 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.756 2.304 . . . . 0.0 113.488 -178.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.6 m -63.66 -33.28 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 121.45 -0.781 . . . . 0.0 109.943 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.413 ' CD2' ' HE ' ' A' ' 10' ' ' ARG . 4.6 m80 -72.47 -40.67 66.77 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 119.417 1.008 . . . . 0.0 108.581 178.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.83 -44.59 90.96 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -61.37 -47.3 86.47 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 124.224 1.01 . . . . 0.0 109.602 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.413 ' HE ' ' CD2' ' A' ' 7' ' ' HIS . 27.3 mtp85 -57.89 -34.83 70.22 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 119.68 1.127 . . . . 0.0 111.76 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 mp -71.26 -46.75 60.26 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 119.991 1.269 . . . . 0.0 107.666 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.23 -34.23 77.63 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.986 -0.53 . . . . 0.0 111.253 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.0 tp -67.75 -44.47 77.46 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.053 0.941 . . . . 0.0 108.818 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -59.92 -45.66 91.88 Favored 'General case' 0 C--O 1.226 -0.151 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.21 -48.11 83.03 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.124 0.57 . . . . 0.0 109.825 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.55 -44.64 93.19 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.36 0.664 . . . . 0.0 109.675 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.9 tt -60.6 -43.43 97.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.107 0.963 . . . . 0.0 110.549 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -58.8 -51.46 69.89 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.4 tt -59.96 -40.05 87.69 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.792 0.837 . . . . 0.0 110.633 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 61.8 tp -63.6 -43.91 95.52 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.381 0.672 . . . . 0.0 110.117 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.51 -42.87 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.25 -48.8 80.27 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.2 tt -59.28 -37.69 78.29 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.084 1.354 . . . . 0.0 110.664 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.2 tt -59.74 -52.04 67.18 Favored 'General case' 0 C--O 1.23 0.061 0 C-N-CA 124.727 1.211 . . . . 0.0 108.546 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 48.3 mm -65.19 -38.4 82.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 43.6 tp -65.08 -13.9 59.15 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -86.15 -44.49 5.94 Favored Glycine 0 C--N 1.341 0.814 0 N-CA-C 107.948 -2.061 . . . . 0.0 107.948 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.82 -36.48 76.88 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -26.69 63.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.508 1.523 . . . . 0.0 111.192 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 73.6 mt -69.09 -19.98 64.07 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.412 -0.805 . . . . 0.0 111.192 179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -104.58 -28.28 11.36 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.734 1.213 . . . . 0.0 109.757 179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.41 -22.82 33.36 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 126.845 2.164 . . . . 0.0 112.094 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.022 0 C-N-CA 128.154 2.582 . . . . 0.0 109.922 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.4 mp . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -74.05 72.3 4.05 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.518 2.812 . . . . 0.0 110.609 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.6 t -71.52 73.83 0.76 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.324 1.45 . . . . 0.0 108.698 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.3 m -63.08 153.17 82.11 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 124.751 1.22 . . . . 0.0 109.257 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.25 -25.9 58.49 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.05 2.5 . . . . 0.0 114.603 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -60.58 -30.53 46.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 119.311 0.96 . . . . 0.0 111.001 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -66.68 -50.11 63.93 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 79.0 mt -59.16 -41.84 89.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -60.86 -48.5 81.54 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.293 1.037 . . . . 0.0 109.9 179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -62.2 -35.94 80.41 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 119.438 1.017 . . . . 0.0 110.962 179.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 69.1 mt -70.46 -44.81 67.01 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.487 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -64.23 -39.55 94.2 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.646 -0.692 . . . . 0.0 110.182 178.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 64.1 tp -63.1 -48.96 76.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.705 0.802 . . . . 0.0 109.258 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -57.91 -45.23 86.8 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.321 0.648 . . . . 0.0 109.908 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.7 mt -64.58 -42.58 95.53 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.77 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.02 -39.13 92.95 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 118.502 0.592 . . . . 0.0 109.905 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.2 tp -65.05 -44.12 90.05 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.1 tp -59.58 -45.58 91.45 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -61.3 -43.39 98.95 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.452 0.701 . . . . 0.0 109.813 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.47 -49.33 77.97 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-N 118.652 0.66 . . . . 0.0 109.571 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 37.0 mm -62.74 -39.43 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.0 tp -61.48 -47.91 83.5 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.161 0.891 . . . . 0.0 109.101 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tt -59.48 -40.08 85.83 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.977 1.311 . . . . 0.0 109.443 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.8 tt -61.63 -51.19 69.49 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -62.12 -23.73 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 124.633 1.173 . . . . 0.0 110.912 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.75 -19.51 62.54 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.664 1.12 . . . . 0.0 109.485 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.07 -44.33 77.76 Favored Glycine 0 C--N 1.343 0.963 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.99 -42.54 80.61 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.9 tt -55.14 -43.14 73.91 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.898 0.879 . . . . 0.0 111.304 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 pp -79.89 -9.12 59.64 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.7 tt -99.59 -29.62 12.59 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.213 1.005 . . . . 0.0 110.77 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 100.26 0.56 55.83 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.453 1.501 . . . . 0.0 113.024 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 62.2 tp . . . . . 0 C--O 1.247 0.942 0 C-N-CA 126.322 1.849 . . . . 0.0 106.765 179.58 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 28.5 mm . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -64.94 169.92 11.09 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 121.834 1.689 . . . . 0.0 109.512 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.3 t -154.76 -147.98 0.23 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.7 p -47.28 154.37 0.82 Allowed Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 127.795 2.438 . . . . 0.0 112.991 -178.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.07 -29.71 87.91 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.952 2.434 . . . . 0.0 113.657 -178.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 42.4 t -68.65 -39.02 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.9 m80 -67.78 -38.31 83.2 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 119.092 0.86 . . . . 0.0 109.364 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.5 mt -58.48 -45.27 89.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 106.684 -1.598 . . . . 0.0 106.684 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -52.74 64.46 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.327 1.051 . . . . 0.0 108.851 177.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -55.27 -34.4 64.03 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.785 1.234 . . . . 0.0 112.577 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mp -73.27 -27.52 61.61 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 119.376 0.989 . . . . 0.0 109.86 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.45 -39.5 18.88 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 120.944 -1.097 . . . . 0.0 109.485 178.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.2 tp -60.74 -41.28 95.06 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 124.947 1.299 . . . . 0.0 108.614 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.3 tt -57.82 -41.73 82.82 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.7 mt -71.7 -39.61 70.08 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.13 -37.44 80.06 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 tt -62.93 -48.85 77.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.233 1.013 . . . . 0.0 108.657 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 92.2 mt -58.02 -43.45 86.75 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.173 -0.676 . . . . 0.0 109.173 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.4 tp -63.44 -38.24 90.38 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.066 0.546 . . . . 0.0 110.417 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.8 tp -63.88 -45.15 90.71 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 118.771 0.714 . . . . 0.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 46.1 mm -63.99 -40.98 91.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.9 tp -59.32 -49.1 79.11 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.73 -41.43 86.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.787 1.235 . . . . 0.0 110.265 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.48 -52.09 67.1 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.688 1.195 . . . . 0.0 108.606 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.2 mt -63.24 -31.37 52.5 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.065 0 C-N-CA 123.303 0.641 . . . . 0.0 110.134 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.79 -16.74 59.35 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.016 0.826 . . . . 0.0 109.423 178.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -79.89 -51.44 5.1 Favored Glycine 0 C--N 1.34 0.775 0 N-CA-C 107.858 -2.097 . . . . 0.0 107.858 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.91 -34.32 77.19 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.153 0.581 . . . . 0.0 109.89 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.0 tt -55.35 -37.96 68.15 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.722 1.209 . . . . 0.0 111.017 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 83.3 mt -69.62 -12.26 61.5 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.226 0.61 . . . . 0.0 112.167 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.4 tp -108.04 -2.27 19.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.653 1.981 . . . . 0.0 110.556 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 122.42 -9.46 9.4 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 116.288 -2.396 . . . . 0.0 115.679 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.9 mp . . . . . 0 N--CA 1.481 1.082 1 C-N-CA 133.404 4.681 . . . . 0.0 109.414 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 35.7 mm . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -67.7 172.34 10.69 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 122.33 2.02 . . . . 0.0 109.901 179.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.9 t 52.56 23.93 2.83 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.46 1.104 . . . . 0.0 113.815 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.7 p -58.43 154.78 31.42 Favored Pre-proline 0 C--O 1.24 0.59 0 CA-C-N 118.853 0.751 . . . . 0.0 110.687 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -60.45 -25.21 79.99 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.828 1.686 . . . . 0.0 111.838 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 36.8 t -65.18 -43.74 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -65.34 -44.38 87.93 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.15 -44.22 87.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -59.66 -49.15 78.87 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 178.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.5 84.63 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.767 0.827 . . . . 0.0 112.223 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -74.56 -25.17 59.13 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.921 0.889 . . . . 0.0 110.965 -178.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.3 -38.73 20.05 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 tp -62.88 -46.9 85.67 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.39 -42.76 87.82 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.241 0.616 . . . . 0.0 110.54 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 64.4 tp -64.85 -47.4 78.07 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.032 0.378 . . . . 0.0 110.49 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -62.21 -42.68 99.53 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.31 -42.98 99.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.285 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.6 tp -58.58 -47.37 84.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.5 tp -62.14 -42.16 98.97 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.642 179.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.15 -46.34 87.62 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.806 0.442 . . . . 0.0 110.284 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 22.3 mm -62.11 -43.1 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.85 -51.36 70.36 Favored 'General case' 0 N--CA 1.461 0.112 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.33 -43.37 83.3 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.355 1.062 . . . . 0.0 110.868 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.63 -46.05 87.46 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.082 0.553 . . . . 0.0 110.061 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.4 mt -64.44 -35.26 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.08 0 C-N-CA 123.182 0.593 . . . . 0.0 110.077 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.8 tt -61.94 -17.15 55.87 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.09 -34.6 36.99 Favored Glycine 0 C--N 1.341 0.832 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.71 -45.19 62.58 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.99 -30.41 69.11 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 122.883 0.473 . . . . 0.0 110.098 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.2 -19.82 64.85 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.301 1.041 . . . . 0.0 111.14 178.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.13 -2.1 21.29 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.72 2.008 . . . . 0.0 110.965 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.33 31.07 20.49 Favored Glycine 0 CA--C 1.529 0.96 0 CA-C-O 118.41 -1.217 . . . . 0.0 113.682 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 116.635 -1.65 . . . . 0.0 107.335 179.652 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.2 mp . . . . . 0 N--CA 1.477 0.878 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -67.23 171.58 11.3 Favored 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 122.234 1.956 . . . . 0.0 111.231 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.4 m -158.76 155.83 28.68 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.751 1.62 . . . . 0.0 106.894 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.3 p -65.26 154.6 86.96 Favored Pre-proline 0 C--O 1.242 0.662 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.35 -25.8 76.59 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 121.478 1.452 . . . . 0.0 110.569 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.7 t -64.59 -48.37 85.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 123.931 0.892 . . . . 0.0 108.837 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -65.75 -38.18 88.38 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.485 1.038 . . . . 0.0 109.147 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.39 -43.8 98.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -62.77 -47.59 82.84 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.55 1.14 . . . . 0.0 108.292 178.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.3 tpm_? -56.63 -39.32 73.46 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.865 1.666 . . . . 0.0 111.266 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.76 -46.37 58.64 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -38.55 86.92 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.269 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.5 tp -66.4 -43.65 85.23 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.666 1.186 . . . . 0.0 109.402 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.56 -46.52 89.87 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.9 mt -63.84 -40.12 95.82 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.529 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.0 -46.75 87.85 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.428 0.558 . . . . 0.0 109.856 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.32 -42.44 98.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.193 0.452 . . . . 0.0 110.338 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.7 tp -60.16 -47.01 87.72 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 tt -60.82 -41.09 95.07 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 123.841 0.856 . . . . 0.0 110.41 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.16 -49.18 76.88 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 118.481 0.582 . . . . 0.0 109.868 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 42.0 mm -64.11 -38.48 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 59.2 tp -60.98 -49.44 77.43 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.09 -39.79 83.28 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.902 1.281 . . . . 0.0 109.933 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.0 tt -61.26 -53.46 56.52 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.9 mt -63.36 -30.41 49.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 123.817 0.847 . . . . 0.0 110.935 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 51.7 tp -62.44 -15.91 52.19 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.067 0.849 . . . . 0.0 109.557 178.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.2 -37.68 87.02 Favored Glycine 0 C--N 1.341 0.814 0 N-CA-C 109.979 -1.248 . . . . 0.0 109.979 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -31.64 71.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.859 0.829 . . . . 0.0 110.146 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -11.81 43.52 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.156 -0.965 . . . . 0.0 111.564 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.7 mt -99.01 -9.26 24.18 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.546 1.138 . . . . 0.0 111.669 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -120.32 -28.14 5.09 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.617 1.167 . . . . 0.0 112.069 -179.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 98.17 0.44 58.47 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 125.309 1.433 . . . . 0.0 111.354 -178.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 pp . . . . . 0 C--O 1.253 1.26 0 C-N-CA 129.045 2.938 . . . . 0.0 106.329 179.563 . . . . . . . . 0 0 . 1 stop_ save_